data_2mwy_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 2mwy _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.424 ' N ' HG21 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.799 0.333 . . . . 0.0 110.878 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.407 ' N ' ' O ' ' A' ' 25' ' ' PHE . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.449 ' HE3' ' CG2' ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.415 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.543 HD12 ' CD2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.543 ' CD2' HD12 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.487 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.45 ' O ' ' NE2' ' A' ' 21' ' ' GLN . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.464 ' CB ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.424 HG21 ' N ' ' A' ' 3' ' ' ASN . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.464 ' HE3' ' CB ' ' A' ' 26' ' ' THR . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.451 ' CG1' HD13 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.466 ' HE1' ' CB ' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.487 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.426 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 40' ' ' VAL . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.522 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 4.8 mm-40 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.562 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 56' ' ' GLY . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.471 HG12 ' CE1' ' B' ' 119' ' ' PHE . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.461 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.501 ' CD2' ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.501 ' ND2' ' CD2' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.451 HD13 ' CG1' ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.449 ' CG2' ' HE3' ' A' ' 8' ' ' LYS . 9.0 t . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' B' ' 123' ' ' TRP . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' B' ' 122' ' ' LEU . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.479 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 19.0 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.468 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.468 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.468 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.472 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.56 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CD2' HD23 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.419 ' HB3' ' N ' ' A' ' 37' ' ' TYR . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.557 ' HB2' ' CD1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.601 ' CD1' ' C ' ' A' ' 24' ' ' MET . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.479 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.489 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.472 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.586 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.403 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.428 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.428 ' N ' HG11 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.453 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.473 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.57 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.57 ' CD2' ' HB3' ' A' ' 48' ' ' GLU . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.485 ' O ' ' CE ' ' A' ' 51' ' ' MET . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.47 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.45 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.473 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 ' CZ ' ' A' ' 68' ' ' PHE . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.416 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.497 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.499 ' CZ ' HD13 ' A' ' 59' ' ' LEU . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.532 HG12 ' CZ ' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.554 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.497 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.5 ' CD2' ' ND2' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.5 ' ND2' ' CD2' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.489 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.468 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.569 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.576 ' CE3' ' CD1' ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.576 ' CD1' ' CE3' ' B' ' 123' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.434 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.761 0.315 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.47 ' CG2' HG23 ' A' ' 30' ' ' VAL . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.462 ' CB ' ' CG1' ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.499 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.431 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.564 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.564 ' CD2' HD23 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.626 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.601 ' CD1' ' C ' ' A' ' 24' ' ' MET . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.477 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.477 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.438 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.626 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.426 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.426 ' N ' HG11 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.451 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.442 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.442 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 5.7 mm-40 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.515 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.543 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.512 ' CB ' ' CD1' ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.512 ' CD1' ' CB ' ' A' ' 54' ' ' CYS . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.462 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.52 HD11 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.494 ' O ' ' CD1' ' B' ' 126' ' ' LEU . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.454 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.474 ' CD2' ' HB2' ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 79' ' ' MET . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.477 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.462 ' CG1' ' CB ' ' A' ' 6' ' ' ARG . 3.6 t . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.627 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 2.9 t80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.47 ' O ' ' CB ' ' B' ' 125' ' ' LEU . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 70' ' ' VAL . 2.6 mp . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.406 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.467 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.464 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.423 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.43 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.441 ' CD2' HE21 ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB1' ' N ' ' A' ' 37' ' ' TYR . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.561 ' HB1' ' CD1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.546 ' CG ' ' O ' ' A' ' 24' ' ' MET . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.405 ' CG2' ' OE1' ' A' ' 4' ' ' GLN . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.406 HG23 ' N ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.467 ' CG2' HG21 ' A' ' 5' ' ' VAL . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.479 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CD1' ' HB1' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.408 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.42 ' N ' ' HB1' ' A' ' 18' ' ' ALA . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.515 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.42 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' N ' HG11 ' A' ' 40' ' ' VAL . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.503 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.515 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.768 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.6 OUTLIER -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.444 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.3 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.514 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.474 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.456 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.414 HD11 ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.455 HD21 ' CB ' ' A' ' 54' ' ' CYS . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.474 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.44 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.473 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.514 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.426 ' N ' HG23 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.463 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.473 ' CG ' ' HG ' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.463 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.467 HD21 ' CG2' ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.464 HG12 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.6 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.6 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.479 ' CD2' ' HE3' ' A' ' 31' ' ' MET . 1.2 tp . . . . . 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.414 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.755 0.312 . . . . 0.0 110.948 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.46 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.486 ' CG2' ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.455 ' O ' ' CG2' ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.499 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.573 HD12 ' CD2' ' A' ' 33' ' ' TYR . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.557 ' CD2' HD21 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 33' ' ' TYR . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.632 ' CB ' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.414 HG23 ' N ' ' A' ' 3' ' ' ASN . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.46 ' CG1' HD23 ' A' ' 84' ' ' LEU . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' A' ' 31' ' ' MET . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.632 ' CE1' ' CB ' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.406 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.56 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' N ' HG12 ' A' ' 40' ' ' VAL . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.499 ' NE2' ' N ' ' A' ' 42' ' ' GLN . 0.2 OUTLIER 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.43 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.756 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.545 ' NE2' ' CB ' ' A' ' 46' ' ' GLN . 5.0 mm-40 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.578 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 9.8 p-80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.569 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.571 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.42 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.417 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.45 HG12 ' CG2' ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.465 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.484 ' CD2' HD21 ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.46 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 0.6 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.484 HD21 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.501 ' O ' ' CG2' ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.896 0.379 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.465 ' HB3' ' CE ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.504 ' O ' ' CD1' ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' B' ' 122' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.504 ' CD1' ' O ' ' B' ' 123' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 4' ' ' GLN . 6.3 t-20 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.803 0.335 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.474 ' H ' ' ND2' ' A' ' 3' ' ' ASN . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.475 HG13 ' CG2' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.464 ' HB3' ' CG1' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.469 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.466 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.642 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.464 ' CG2' ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.52 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.559 ' CE ' ' CD2' ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.457 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.642 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.483 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' N ' HG12 ' A' ' 40' ' ' VAL . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.648 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.555 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.555 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.424 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 8.4 mm-40 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.442 ' HB3' ' CD1' ' B' ' 122' ' ' LEU . 5.9 p-80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.422 ' CA ' ' HE1' ' A' ' 51' ' ' MET . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.566 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.598 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.412 ' CD2' ' N ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.412 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.484 ' CD1' ' C ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.479 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.405 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.445 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CD2' ' SG ' ' A' ' 54' ' ' CYS . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.42 HG21 ' N ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.462 ' CE ' HD21 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.479 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.471 ' CD1' ' N ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.472 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.52 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.464 ' CG1' ' HB3' ' A' ' 6' ' ' ARG . 2.3 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.418 ' HE1' ' CE3' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.862 0.363 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' B' ' 125' ' ' LEU . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.486 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.559 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.403 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.775 0.321 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.472 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.415 ' N ' HG21 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.535 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.45 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.422 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.422 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.518 ' CD2' HD23 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.433 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.557 ' HB1' ' CD1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.411 ' O ' ' CG2' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.403 HG22 ' N ' ' A' ' 3' ' ' ASN . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.455 ' CG2' HG22 ' A' ' 5' ' ' VAL . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.604 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.54 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.433 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.411 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.417 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.417 ' N ' HG13 ' A' ' 40' ' ' VAL . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.459 ' CD1' HD23 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.8 mm-40 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.527 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 7.9 p-80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.558 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.429 ' SG ' ' CA ' ' A' ' 60' ' ' GLY . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.459 HD23 ' CD1' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.456 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.408 ' O ' ' SG ' ' A' ' 54' ' ' CYS . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.558 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.566 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.422 ' N ' HG22 ' A' ' 70' ' ' VAL . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.46 HD23 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.476 ' N ' HD13 ' A' ' 80' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.408 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.472 ' CD2' ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.566 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.467 ' O ' ' C ' ' B' ' 123' ' ' TRP . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.515 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.813 0.339 . . . . 0.0 110.862 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.515 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.468 HG22 ' CG2' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.464 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.439 ' CA ' ' HB3' ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.439 ' HB3' ' CA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.417 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.417 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.464 ' HB3' ' CB ' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.525 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' CB ' ' HB3' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HG22 ' A' ' 5' ' ' VAL . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.462 ' CE ' HD21 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.525 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.438 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.408 ' CD1' HG22 ' A' ' 52' ' ' VAL . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.595 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.458 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.595 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.457 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 6.0 mm-40 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 48' ' ' GLU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.429 ' HE1' ' N ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.569 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.458 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.413 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.411 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.458 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.529 HD12 ' CD2' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.612 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.454 HD21 ' CD2' ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.506 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.482 ' CD2' ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.506 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.46 HD11 ' CG1' ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 7.3 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.571 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.892 0.377 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.571 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.462 HD21 ' CE ' ' A' ' 31' ' ' MET . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.764 0.316 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.472 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.643 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.643 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.486 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CD2' HD12 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.583 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.455 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.474 HG13 ' CD2' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.467 ' HE1' ' CD1' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.403 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.473 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.576 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.455 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.468 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.479 ' NE2' ' O ' ' A' ' 39' ' ' MET . 17.6 mm-40 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.576 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.621 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.3 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.418 ' HA ' ' CG2' ' A' ' 70' ' ' VAL . 29.2 p-80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.537 HG23 ' CE1' ' A' ' 68' ' ' PHE . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.452 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.485 ' CD2' ' N ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.485 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.405 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.461 HD11 ' N ' ' A' ' 80' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.486 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.474 ' CD2' HG13 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.493 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.847 0.356 . . . . 0.0 110.87 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.457 ' CD2' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.451 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.467 ' CD1' ' HE1' ' A' ' 31' ' ' MET . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.492 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.739 0.305 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.492 ' N ' HD21 ' A' ' 3' ' ' ASN . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.472 ' CG2' HD11 ' A' ' 84' ' ' LEU . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.57 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.574 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CD2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.48 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.647 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.57 ' CD1' ' C ' ' A' ' 24' ' ' MET . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.519 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.488 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.428 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.647 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.483 ' NE2' ' N ' ' A' ' 36' ' ' GLN . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.414 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.532 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 40' ' ' VAL . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.664 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.49 ' CD2' ' O ' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.539 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.539 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.519 ' CG ' ' HE3' ' A' ' 71' ' ' LYS . 3.5 p-80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.563 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 43' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.472 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.44 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.453 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.499 ' CD2' ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.4 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.465 HG12 ' CG2' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.519 ' HE3' ' CG ' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.645 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.466 ' O ' ' CD1' ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.505 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.519 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 3.3 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.856 0.36 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' B' ' 121' ' ' ASP . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.468 ' CD1' ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.55 ' CD2' ' CZ3' ' B' ' 123' ' ' TRP . 6.3 tp . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.753 0.311 . . . . 0.0 110.951 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.52 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.472 ' CB ' HG13 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.484 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB3' ' CB ' ' A' ' 7' ' ' PRO . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.562 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.421 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.649 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.596 ' CD1' ' C ' ' A' ' 24' ' ' MET . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.456 ' OG1' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.503 ' N ' ' CG1' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.479 HG21 ' CG2' ' A' ' 5' ' ' VAL . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.494 ' CE ' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.649 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.503 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.424 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.462 ' CD2' ' HB3' ' A' ' 41' ' ' LYS . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.503 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.632 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.41 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.433 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.433 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.455 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.495 ' O ' ' CD1' ' A' ' 80' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.561 ' CB ' ' O ' ' A' ' 79' ' ' MET . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 80' ' ' LEU . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.47 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.857 0.36 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.542 ' N ' ' CD1' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.494 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 6.4 tp . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.606 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 0.0 110.901 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.441 ' NE2' ' OD1' ' A' ' 3' ' ' ASN . 2.2 mp0 -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.41 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.527 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.548 ' CG ' ' O ' ' A' ' 24' ' ' MET . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.606 HG13 ' N ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.412 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.445 HG11 ' CD2' ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.607 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.469 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.453 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.55 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' LYS . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.428 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.5 mm-40 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.42 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.444 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.478 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.571 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.428 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.562 HG11 ' CZ ' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.427 ' N ' HG21 ' A' ' 70' ' ' VAL . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.571 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.519 ' CB ' ' O ' ' A' ' 79' ' ' MET . 45.9 t30 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 1.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.575 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' B' ' 123' ' ' TRP . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' B' ' 122' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.497 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.454 ' CD2' ' HA ' ' A' ' 21' ' ' GLN . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.421 ' HB2' ' N ' ' A' ' 37' ' ' TYR . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.454 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.603 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.435 ' OG1' ' NZ ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.467 ' CG1' HD11 ' A' ' 84' ' ' LEU . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.551 ' SD ' ' CE2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.421 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.503 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.6 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.609 ' O ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.609 ' NE2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.6 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.5 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.3 mm-40 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CE1' ' HG2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.533 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.565 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.601 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.471 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.471 ' CD2' ' HB3' ' A' ' 57' ' ' ASP . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.477 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.404 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.601 ' CD2' ' SG ' ' A' ' 54' ' ' CYS . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.426 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.466 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.438 ' N ' HG23 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.471 ' CE ' HD23 ' A' ' 80' ' ' LEU . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.474 HD21 ' CD1' ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.455 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 0.4 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.474 ' CD1' HD21 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.497 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 2.9 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.879 0.371 . . . . 0.0 110.908 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' B' ' 125' ' ' LEU . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.588 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.456 ' CD2' ' O ' ' B' ' 123' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.473 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 19.6 m120 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.779 0.323 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.529 ' CG1' ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.412 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.501 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.565 HD12 ' CD2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.463 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.413 ' CD1' ' CD1' ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CD2' HD12 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.46 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.637 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.473 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.412 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.471 ' CG1' HD21 ' A' ' 84' ' ' LEU . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.477 ' HE3' ' CD1' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.637 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.46 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.41 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.429 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.487 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.524 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.4 mp0 -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.436 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 26.1 p-80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.512 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.464 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.426 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.491 ' CD2' ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.559 HG11 ' CE1' ' B' ' 119' ' ' PHE . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.558 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' A' ' 72' ' ' ASP . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' O ' HD11 ' A' ' 80' ' ' LEU . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.458 ' CD1' ' N ' ' A' ' 80' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.529 ' CD1' ' CG1' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 10.8 t . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.559 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.839 0.352 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.481 ' CZ2' ' N ' ' A' ' 35' ' ' GLY . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.477 ' CD1' ' HE3' ' A' ' 31' ' ' MET . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.494 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.808 0.337 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.483 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.483 ' CG1' ' O ' ' A' ' 4' ' ' GLN . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.404 ' CB ' HG13 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.472 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.47 ' HB3' ' CB ' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.472 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.495 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.47 ' CB ' ' HB3' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.606 ' CD1' ' C ' ' A' ' 24' ' ' MET . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.489 ' O ' ' CG2' ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.494 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.535 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.474 ' HE2' ' CD1' ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.495 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.413 HD13 ' CG2' ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.568 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.521 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.6 mp0 -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.484 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.4 mm-40 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.702 ' CE1' ' CD2' ' B' ' 122' ' ' LEU . 14.0 m80 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.527 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.436 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.436 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.495 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.461 HD21 ' CB ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.527 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.411 HG11 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.6 ' HE2' ' CE1' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.424 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.522 ' CB ' ' O ' ' A' ' 79' ' ' MET . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.409 ' O ' ' CB ' ' A' ' 5' ' ' VAL . 3.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 4.2 t80 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.89 0.376 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.702 ' CD2' ' CE1' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.605 ' CE3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.605 HD11 ' CE3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.484 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.484 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.484 ' HG ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.484 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.42 HD12 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.426 ' NE2' ' HA ' ' A' ' 21' ' ' GLN . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.558 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.455 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.6 ' CD1' ' C ' ' A' ' 24' ' ' MET . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.47 HG11 ' CD2' ' A' ' 84' ' ' LEU . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.452 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.608 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.443 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.592 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.433 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.457 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.9 mp0 -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.475 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.5 mm-40 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.537 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.537 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 1.4 p-80 -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.491 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.569 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.461 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.461 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.471 ' CG2' HD21 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.52 ' CB ' ' O ' ' A' ' 79' ' ' MET . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 3.6 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.832 0.349 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.471 HD21 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.452 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.6 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.816 0.341 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.474 HG22 ' CG2' ' A' ' 30' ' ' VAL . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.487 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.468 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.416 HD23 ' CG2' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.567 HD13 ' CD2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.42 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CD2' HD13 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.43 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.569 ' HB2' ' CD1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.477 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.595 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.454 ' OG1' ' CE ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.466 ' N ' ' O ' ' A' ' 3' ' ' ASN . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.509 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.474 ' CG2' HG22 ' A' ' 5' ' ' VAL . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.423 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.569 ' CD1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.43 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.424 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.456 ' CB ' HD13 ' A' ' 43' ' ' LEU . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.463 HD11 ' CB ' ' A' ' 57' ' ' ASP . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.765 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.7 OUTLIER -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.612 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.1 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.565 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.461 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.463 ' CB ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.535 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.461 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.544 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.417 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.415 ' O ' ' SG ' ' A' ' 54' ' ' CYS . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.461 HG13 ' CE1' ' B' ' 119' ' ' PHE . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.46 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.477 HD23 ' CE ' ' A' ' 31' ' ' MET . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.544 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.6 t30 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.47 HD11 ' CG1' ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.487 ' CG1' ' O ' ' A' ' 6' ' ' ARG . 73.3 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.568 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.886 0.374 . . . . 0.0 110.915 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.439 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.6 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.6 ' CD2' ' CZ3' ' B' ' 123' ' ' TRP . 11.1 tp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.49 ' N ' HG11 ' A' ' 27' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.776 0.322 . . . . 0.0 110.89 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.495 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.517 ' CG2' ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.44 ' CB ' HG12 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.471 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.568 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.577 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CD2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.435 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB3' ' CD1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' A' ' 24' ' ' MET . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.49 HG11 ' N ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.551 ' SD ' ' CE2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.427 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.577 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.587 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.432 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' CD1' HD22 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.587 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.522 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.467 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.9 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.452 ' O ' ' CG1' ' A' ' 70' ' ' VAL . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.496 ' CD2' ' HG2' ' A' ' 51' ' ' MET . 2.1 p-80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.666 ' CG1' ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.449 ' N ' HG22 ' A' ' 52' ' ' VAL . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.518 ' CB ' ' CD1' ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD1' ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.491 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.474 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.433 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.666 ' CD1' ' CG1' ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.475 ' CG2' ' N ' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.475 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.418 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.479 HD23 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.475 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 79' ' ' MET . 44.4 t30 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.475 ' CD2' ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.44 HG12 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.714 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.892 0.377 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.423 ' O ' ' C ' ' B' ' 123' ' ' TRP . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.502 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.502 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.499 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.499 ' N ' HD21 ' A' ' 3' ' ' ASN . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.473 ' HB ' ' CD1' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.411 ' N ' HG21 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.482 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.414 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.569 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.562 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.419 ' HB2' ' N ' ' A' ' 37' ' ' TYR . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.519 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.405 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.433 ' CG2' HG22 ' A' ' 5' ' ' VAL . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.435 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.596 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.4 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.469 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' N ' HG11 ' A' ' 40' ' ' VAL . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.53 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.416 HD21 ' N ' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.472 ' CB ' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 7.1 mm-40 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.57 ' CD2' ' HE3' ' A' ' 71' ' ' LYS . 2.0 p-80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.504 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.47 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.447 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.566 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.497 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.57 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.59 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.569 ' HD2' ' O ' ' A' ' 72' ' ' ASP . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD2' HD21 ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.59 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.548 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.473 ' CD1' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' B' ' 122' ' ' LEU . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.481 HD21 ' CD2' ' A' ' 76' ' ' LEU . 5.3 mp . . . . . 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.472 ' H ' ' CG2' ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.471 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.3 mp0 -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.454 HG23 ' CG2' ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.443 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.477 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.469 HD11 ' CD2' ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.477 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.469 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.437 ' OG1' ' NZ ' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.472 ' CG2' ' H ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.454 ' CG2' HG23 ' A' ' 5' ' ' VAL . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.585 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.517 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.469 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.598 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.491 ' CB ' ' CD2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.491 ' CD2' ' CB ' ' A' ' 41' ' ' LYS . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.514 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.2 mp0 -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.484 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.6 mm-40 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.43 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.594 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 2.8 p-80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.504 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.469 ' CD2' HD11 ' A' ' 14' ' ' ILE . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.422 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.545 ' HB3' ' CD ' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.545 ' CD ' ' HB3' ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.504 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.468 ' CG1' HG21 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 80' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.457 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.483 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.457 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.431 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.523 ' O ' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' PHE . . . . . 0.582 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.419 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 2' ' ' ILE . 52.9 mm-40 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.794 0.33 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.473 ' CD1' ' HE2' ' A' ' 28' ' ' LYS . 1.4 pp -37.6 111.45 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.148 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.424 ' N ' HG21 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -115.46 174.56 5.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.407 ' N ' ' O ' ' A' ' 25' ' ' PHE . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.449 ' HE3' ' CG2' ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.415 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.543 HD12 ' CD2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.543 ' CD2' HD12 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.487 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.45 ' O ' ' NE2' ' A' ' 21' ' ' GLN . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.464 ' CB ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.472 ' CG2' ' HA ' ' A' ' 2' ' ' ILE . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.473 ' HE2' ' CD1' ' A' ' 2' ' ' ILE . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.451 ' CG1' HD13 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.466 ' HE1' ' CB ' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.487 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.426 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 40' ' ' VAL . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.522 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 4.8 mm-40 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.562 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 56' ' ' GLY . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.471 HG12 ' CE1' ' B' ' 119' ' ' PHE . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.461 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.501 ' CD2' ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.501 ' ND2' ' CD2' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.451 HD13 ' CG1' ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.449 ' CG2' ' HE3' ' A' ' 8' ' ' LYS . 9.0 t -61.17 99.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.0 p -99.27 161.87 13.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.157 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.41 173.22 7.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.9 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 75.97 37.98 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.092 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -88.49 142.32 27.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.947 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.4 OUTLIER -132.67 -72.99 0.51 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.877 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.417 ' O ' ' N ' ' B' ' 121' ' ' ASP . 0.2 OUTLIER 37.88 -152.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.125 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -37.54 -43.55 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' B' ' 118' ' ' THR . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' B' ' 123' ' ' TRP . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' B' ' 122' ' ' LEU . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -42.6 102.59 0.28 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 91.62 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.692 2.261 . . . . 0.0 112.373 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -38.32 -33.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.453 ' O ' ' CG1' ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.795 0.331 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.478 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 45.8 mm -130.9 40.34 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.479 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -114.54 -168.89 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.883 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 19.0 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.468 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.468 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.468 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.472 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.56 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.56 ' CD2' HD23 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.419 ' HB3' ' N ' ' A' ' 37' ' ' TYR . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.557 ' HB2' ' CD1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.601 ' CD1' ' C ' ' A' ' 24' ' ' MET . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.479 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.489 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.472 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.586 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.403 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.428 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.428 ' N ' HG11 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.453 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.473 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.57 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.57 ' CD2' ' HB3' ' A' ' 48' ' ' GLU . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.485 ' O ' ' CE ' ' A' ' 51' ' ' MET . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.47 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.45 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.473 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.499 HD13 ' CZ ' ' A' ' 68' ' ' PHE . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.416 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.497 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.499 ' CZ ' HD13 ' A' ' 59' ' ' LEU . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.532 HG12 ' CZ ' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.554 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.467 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.406 ' OH ' ' O ' ' B' ' 127' ' ' PRO . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.497 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.5 ' CD2' ' ND2' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.5 ' ND2' ' CD2' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.489 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.468 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t -44.9 135.85 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 13.6 p -134.9 140.24 45.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.14 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.65 50.3 0.88 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.14 19.1 9.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.056 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.09 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 89.9 p . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.779 0.324 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 59.99 14.83 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' B' ' 118' ' ' THR . 1.5 mm-40 -114.05 148.92 36.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.884 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.476 ' CB ' ' O ' ' B' ' 117' ' ' GLU . 0.1 OUTLIER 160.68 -65.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.155 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.569 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -64.14 -39.57 94.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.576 ' CE3' ' CD1' ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.576 ' CD1' ' CE3' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -37.82 124.02 0.99 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.467 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.77 66.87 1.76 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.682 2.254 . . . . 0.0 112.343 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -37.99 -52.93 1.38 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.472 ' HA ' ' CG1' ' A' ' 2' ' ' ILE . 4.9 m120 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.726 0.298 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.428 ' CD1' ' HD3' ' A' ' 28' ' ' LYS . 5.9 mm -70.56 90.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.146 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.489 ' OD1' ' CB ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -90.51 -174.22 4.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.899 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.47 ' CG2' HG23 ' A' ' 30' ' ' VAL . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.462 ' CB ' ' CG1' ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.499 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.431 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.564 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.564 ' CD2' HD23 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.626 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.601 ' CD1' ' C ' ' A' ' 24' ' ' MET . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HD2' ' CB ' ' B' ' 129' ' ' ASN . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.477 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.477 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.438 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.626 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.426 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.426 ' N ' HG11 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.451 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.442 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.442 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 5.7 mm-40 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.515 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.543 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.512 ' CB ' ' CD1' ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.512 ' CD1' ' CB ' ' A' ' 54' ' ' CYS . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.462 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.52 HD11 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.494 ' O ' ' CD1' ' B' ' 126' ' ' LEU . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.454 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.474 ' CD2' ' HB2' ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 79' ' ' MET . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.477 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.462 ' CG1' ' CB ' ' A' ' 6' ' ' ARG . 3.6 t -37.17 142.15 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.5 p -148.71 123.1 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.153 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.439 ' O ' ' ND2' ' A' ' 3' ' ' ASN . 3.6 mp -90.73 92.73 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.874 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.489 ' CB ' ' OD1' ' A' ' 3' ' ' ASN . . . -137.31 -157.87 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.13 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.133 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -169.26 54.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.88 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -99.62 127.63 45.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.454 ' CG2' ' N ' ' B' ' 119' ' ' PHE . 3.7 t -173.45 -156.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.179 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.627 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 2.9 t80 -49.74 -32.4 13.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.47 ' O ' ' CB ' ' B' ' 125' ' ' LEU . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 70' ' ' VAL . 2.6 mp -46.67 164.44 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 64.7 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.487 ' O ' ' CB ' ' B' ' 129' ' ' ASN . 4.1 pt-20 -120.4 99.89 6.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' B' ' 128' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.451 ' N ' ' C ' ' B' ' 129' ' ' ASN . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.76 0.314 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.44 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 8.7 mm -37.72 154.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.173 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.44 ' N ' ' CG2' ' A' ' 2' ' ' ILE . 0.1 OUTLIER -167.73 -179.77 4.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.891 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.467 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.464 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.423 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.423 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.43 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.441 ' CD2' HE21 ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB1' ' N ' ' A' ' 37' ' ' TYR . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.561 ' HB1' ' CD1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.546 ' CG ' ' O ' ' A' ' 24' ' ' MET . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.405 ' CG2' ' OE1' ' A' ' 4' ' ' GLN . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.406 HG23 ' N ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.467 ' CG2' HG21 ' A' ' 5' ' ' VAL . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.479 ' HE3' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CD1' ' HB1' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.408 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.42 ' N ' ' HB1' ' A' ' 18' ' ' ALA . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.515 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.42 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' N ' HG11 ' A' ' 40' ' ' VAL . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.503 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.515 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.768 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.6 OUTLIER -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.444 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.3 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.514 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.474 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.456 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.414 HD11 ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.455 HD21 ' CB ' ' A' ' 54' ' ' CYS . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.474 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.44 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.514 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.426 ' N ' HG23 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.463 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.473 ' CG ' ' HG ' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.467 HD21 ' CG2' ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.464 HG12 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t -37.51 142.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.3 p -139.52 152.74 47.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.156 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.34 -38.39 3.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.883 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -94.71 132.79 39.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.14 -179.904 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.14 -169.94 2.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.88 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -163.02 -40.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.27 -153.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.189 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.6 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -40.92 -42.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.881 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.6 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.479 ' CD2' ' HE3' ' A' ' 31' ' ' MET . 1.2 tp -42.29 102.45 0.27 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 85.14 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.667 2.244 . . . . 0.0 112.324 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.462 ' O ' ' CB ' ' B' ' 129' ' ' ASN . 1.9 mp0 -46.67 -24.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.462 ' CB ' ' O ' ' B' ' 128' ' ' GLU . 1.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.821 0.343 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.479 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 19.0 mm -131.94 65.47 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.144 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.454 ' OD1' ' CB ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -108.76 -175.78 2.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.46 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.486 ' CG2' ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.455 ' O ' ' CG2' ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.499 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.573 HD12 ' CD2' ' A' ' 33' ' ' TYR . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.557 ' CD2' HD21 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 33' ' ' TYR . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.632 ' CB ' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.458 ' CG2' ' HA ' ' A' ' 2' ' ' ILE . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.46 ' CG1' HD23 ' A' ' 84' ' ' LEU . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' A' ' 31' ' ' MET . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.632 ' CE1' ' CB ' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.406 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.56 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' N ' HG12 ' A' ' 40' ' ' VAL . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' NE2' ' N ' ' A' ' 42' ' ' GLN . 0.2 OUTLIER 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.56 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.43 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.756 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.545 ' NE2' ' CB ' ' A' ' 46' ' ' GLN . 5.0 mm-40 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.578 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 9.8 p-80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.569 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.571 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.42 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.417 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.45 HG12 ' CG2' ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.465 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.466 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.484 ' CD2' HD21 ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.46 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 0.6 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.484 HD21 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.501 ' O ' ' CG2' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -117.4 85.08 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.3 p -100.31 153.04 19.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.138 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.435 ' O ' ' CB ' ' A' ' 88' ' ' ALA . 3.1 mp -112.66 95.39 5.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.454 ' CB ' ' OD1' ' A' ' 3' ' ' ASN . . . 166.23 72.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.809 0.337 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 47' ' ' GLN . 2.0 tt0 -178.01 82.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -129.79 179.54 5.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 121' ' ' ASP . 2.2 m -84.22 148.58 26.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.145 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -43.45 -57.76 2.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.894 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 118' ' ' THR . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.465 ' HB3' ' CE ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.504 ' O ' ' CD1' ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' B' ' 122' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.504 ' CD1' ' O ' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -37.01 142.36 0.37 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.466 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 53.7 Cg_endo -69.71 -14.45 36.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 0.0 112.366 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.449 ' CG ' ' C ' ' B' ' 127' ' ' PRO . 0.3 OUTLIER 75.7 -55.38 0.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.446 ' CD1' ' HD3' ' A' ' 28' ' ' LYS . 5.2 mm -97.47 99.14 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 4' ' ' GLN . 6.3 t-20 -88.04 154.49 20.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.893 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.474 ' H ' ' ND2' ' A' ' 3' ' ' ASN . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.475 HG13 ' CG2' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.464 ' HB3' ' CG1' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.411 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.469 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.466 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.642 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.464 ' CG2' ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.446 ' HD3' ' CD1' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.52 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.559 ' CE ' ' CD2' ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.457 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.642 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.483 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' N ' HG12 ' A' ' 40' ' ' VAL . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.648 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.555 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.555 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.424 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 8.4 mm-40 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' OE1' ' O ' ' B' ' 117' ' ' GLU . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.442 ' HB3' ' CD1' ' B' ' 122' ' ' LEU . 5.9 p-80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.422 ' CA ' ' HE1' ' A' ' 51' ' ' MET . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.566 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.598 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.412 ' CD2' ' N ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.412 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.484 ' CD1' ' C ' ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.479 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.405 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.445 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CD2' ' SG ' ' A' ' 54' ' ' CYS . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.42 HG21 ' N ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.462 ' CE ' HD21 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.479 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.471 ' CD1' ' N ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.472 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.52 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.464 ' CG1' ' HB3' ' A' ' 6' ' ' ARG . 2.3 t -42.84 135.03 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.6 p -132.95 130.08 39.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.167 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.45 ' CD2' ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -95.76 118.91 33.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.97 113.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.116 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.806 0.336 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.64 153.59 47.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 49' ' ' GLN . 1.3 mt-10 -133.63 138.55 45.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 1.3 m -137.22 146.04 44.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.418 ' HE1' ' CE3' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -44.06 -59.01 2.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.414 ' CB ' ' O ' ' B' ' 118' ' ' THR . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' B' ' 125' ' ' LEU . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.486 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.559 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER -37.42 136.94 0.67 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.472 ' O ' ' C ' ' B' ' 128' ' ' GLU . 54.0 Cg_endo -69.7 -0.2 6.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.706 2.271 . . . . 0.0 112.323 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.482 ' CG ' ' HG2' ' A' ' 31' ' ' MET . 0.0 OUTLIER -32.15 -39.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.891 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.434 ' N ' ' O ' ' B' ' 127' ' ' PRO . 5.1 t-20 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.432 ' CD1' ' C ' ' B' ' 129' ' ' ASN . 2.7 mm -94.71 72.05 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.117 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.403 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -82.39 136.31 34.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.472 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.415 ' N ' HG21 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.535 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.45 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.422 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.422 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.518 ' CD2' HD23 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.433 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.557 ' HB1' ' CD1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.411 ' O ' ' CG2' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.403 HG22 ' N ' ' A' ' 3' ' ' ASN . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HG3' ' CB ' ' B' ' 128' ' ' GLU . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.455 ' CG2' HG22 ' A' ' 5' ' ' VAL . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.604 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.54 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.433 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.411 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.417 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.417 ' N ' HG13 ' A' ' 40' ' ' VAL . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.459 ' CD1' HD23 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.8 mm-40 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.527 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 7.9 p-80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.558 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.429 ' SG ' ' CA ' ' A' ' 60' ' ' GLY . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.459 HD23 ' CD1' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.456 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.456 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.408 ' O ' ' SG ' ' A' ' 54' ' ' CYS . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.558 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.566 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.422 ' N ' HG22 ' A' ' 70' ' ' VAL . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.46 HD23 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.476 ' N ' HD13 ' A' ' 80' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.408 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.472 ' CD2' ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.406 HG11 ' N ' ' A' ' 86' ' ' THR . 1.3 t -48.22 151.88 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.406 ' N ' HG11 ' A' ' 85' ' ' VAL . 20.0 p -141.29 121.89 14.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.183 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.487 ' CD2' ' N ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER -96.75 -36.04 10.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.07 112.24 25.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.098 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.1 -166.36 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.5 OUTLIER -104.29 -156.62 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.4 ' C ' ' O ' ' B' ' 117' ' ' GLU . 0.2 OUTLIER 37.61 -152.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.13 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.566 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -38.05 -42.81 0.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.467 ' O ' ' C ' ' B' ' 123' ' ' TRP . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp -57.53 127.42 77.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.447 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 54.0 Cg_endo -69.78 65.1 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 0.0 112.357 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.455 ' CB ' ' HG3' ' A' ' 28' ' ' LYS . 9.8 mt-10 -40.08 -68.88 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.432 ' C ' ' CD1' ' A' ' 2' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.718 0.294 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 21.4 mm -137.17 54.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.515 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -90.41 131.86 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.515 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.468 HG22 ' CG2' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.464 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.439 ' CA ' ' HB3' ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.439 ' HB3' ' CA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.417 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.464 ' HB3' ' CB ' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' HD21 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.525 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' CB ' ' HB3' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.468 ' CG2' HG22 ' A' ' 5' ' ' VAL . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.472 ' CG ' ' HA ' ' B' ' 128' ' ' GLU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.525 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.408 ' CD1' HG22 ' A' ' 52' ' ' VAL . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.595 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.458 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.595 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.457 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 6.0 mm-40 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.563 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.563 ' CE1' ' HB2' ' A' ' 48' ' ' GLU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.429 ' HE1' ' N ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.569 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.458 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.413 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.411 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.458 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.529 HD12 ' CD2' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.455 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.612 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.454 HD21 ' CD2' ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.506 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.482 ' CD2' ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.506 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD11 ' CG1' ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 7.3 t -58.4 83.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 84' ' ' LEU . 51.8 p -102.55 147.97 26.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.11 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.474 ' O ' ' CB ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -110.96 151.72 27.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.913 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.474 ' CB ' ' O ' ' A' ' 87' ' ' LEU . . . 82.93 144.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.176 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.867 0.365 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 27.9 mm100 -38.73 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 76.01 141.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.856 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' B' ' 119' ' ' PHE . 5.2 t -174.65 -152.09 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.161 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.571 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -48.78 -30.22 5.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.94 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.571 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.462 HD21 ' CE ' ' A' ' 31' ' ' MET . 0.1 OUTLIER -66.14 164.53 28.75 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 62.55 1.75 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.637 2.224 . . . . 0.0 112.341 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -65.61 -41.42 92.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.807 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.404 ' C ' ' O ' ' B' ' 128' ' ' GLU . 34.1 m-80 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.549 ' CD1' ' N ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER 54.52 106.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.13 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER -125.21 119.85 29.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.472 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.643 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.643 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.486 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.567 HD12 ' CD2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CD2' HD12 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.583 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.467 ' CG2' HG21 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.455 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.463 ' HD3' ' CD1' ' A' ' 2' ' ' ILE . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.474 HG13 ' CD2' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.467 ' HE1' ' CD1' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.403 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.473 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.576 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.455 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.468 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.479 ' NE2' ' O ' ' A' ' 39' ' ' MET . 17.6 mm-40 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' CD2' ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.576 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.621 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.3 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.418 ' HA ' ' CG2' ' A' ' 70' ' ' VAL . 29.2 p-80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.537 HG23 ' CE1' ' A' ' 68' ' ' PHE . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.452 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.485 ' CD2' ' N ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.485 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.551 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' CD2' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.468 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.455 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.405 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.461 HD11 ' N ' ' A' ' 80' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.486 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.474 ' CD2' HG13 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.493 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -68.0 151.78 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.405 ' N ' HG13 ' A' ' 85' ' ' VAL . 3.3 p -143.79 116.69 8.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.134 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.462 ' O ' ' CB ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -106.71 143.03 35.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 87' ' ' LEU . . . 82.47 143.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 68.9 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.849 0.357 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.57 -166.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.34 -160.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.406 ' O ' ' C ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 43.33 -152.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.67 -42.33 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' B' ' 118' ' ' THR . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.457 ' CD2' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.451 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.467 ' CD1' ' HE1' ' A' ' 31' ' ' MET . 0.3 OUTLIER -40.69 137.76 1.35 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.468 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.3 Cg_endo -69.74 -11.29 30.57 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.691 2.26 . . . . 0.0 112.38 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.421 ' O ' ' CG2' ' A' ' 27' ' ' VAL . 64.2 mt-10 63.94 -73.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' B' ' 127' ' ' PRO . 12.2 t30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.841 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.495 ' CD1' ' OE1' ' B' ' 128' ' ' GLU . 4.9 mm 58.44 42.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.174 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.492 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -87.43 133.79 33.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.492 ' N ' HD21 ' A' ' 3' ' ' ASN . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.472 ' CG2' HD11 ' A' ' 84' ' ' LEU . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.455 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.57 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.574 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.57 ' CD2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.48 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.647 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.57 ' CD1' ' C ' ' A' ' 24' ' ' MET . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.461 ' CD ' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.519 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.488 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.428 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.647 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.483 ' NE2' ' N ' ' A' ' 36' ' ' GLN . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.414 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.532 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 40' ' ' VAL . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.664 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.49 ' CD2' ' O ' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.539 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.539 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.519 ' CG ' ' HE3' ' A' ' 71' ' ' LYS . 3.5 p-80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.563 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 43' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.472 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.44 ' N ' ' CD2' ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.453 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.499 ' CD2' ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.4 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.563 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.465 HG12 ' CG2' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.519 ' HE3' ' CG ' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.645 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.466 ' O ' ' CD1' ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.505 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.519 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 3.3 t -57.86 87.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.467 ' CG2' HG12 ' A' ' 5' ' ' VAL . 26.9 p -98.36 156.56 16.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.12 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 89' ' ' THR . 0.0 OUTLIER -146.06 -59.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -37.86 95.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.051 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 87' ' ' LEU . 2.7 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.147 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -152.33 93.44 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.913 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -120.21 133.59 55.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.425 ' O ' ' N ' ' B' ' 121' ' ' ASP . 97.0 m -66.3 154.35 40.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -43.02 -55.54 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' B' ' 118' ' ' THR . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.468 ' CD1' ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.55 ' CD2' ' CZ3' ' B' ' 123' ' ' TRP . 6.3 tp -46.67 104.71 0.42 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 155.61 65.75 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 0.0 112.343 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.495 ' OE1' ' CD1' ' A' ' 2' ' ' ILE . 0.5 OUTLIER -98.32 -30.78 12.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.994 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.806 0.336 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 mm -114.79 117.87 56.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' OD1' ' CB ' ' A' ' 88' ' ' ALA . 0.6 OUTLIER -109.59 178.2 4.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.52 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.472 ' CB ' HG13 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.484 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB3' ' CB ' ' A' ' 7' ' ' PRO . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.562 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.562 ' CD2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.649 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.596 ' CD1' ' C ' ' A' ' 24' ' ' MET . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.456 ' OG1' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.503 ' N ' ' CG1' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.479 HG21 ' CG2' ' A' ' 5' ' ' VAL . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.494 ' CE ' ' CD2' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.649 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.503 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.424 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.462 ' CD2' ' HB3' ' A' ' 41' ' ' LYS . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.503 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.632 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.41 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.433 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.433 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.455 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.495 ' O ' ' CD1' ' A' ' 80' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.561 ' CB ' ' O ' ' A' ' 79' ' ' MET . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' A' ' 80' ' ' LEU . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -85.13 13.65 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 85' ' ' VAL . 0.8 OUTLIER -34.56 101.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 88' ' ' ALA . 0.3 OUTLIER -107.0 105.92 16.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.91 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.5 ' CB ' ' O ' ' A' ' 87' ' ' LEU . . . 161.96 71.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.086 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.142 -179.887 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.11 152.82 24.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.92 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -143.39 129.64 19.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.888 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 1.3 m -128.88 143.01 50.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.47 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -47.04 -59.07 3.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.542 ' N ' ' CD1' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.494 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 6.4 tp -46.12 104.57 0.41 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.686 2.258 . . . . 0.0 112.337 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -7.63 58.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 m120 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.929 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.483 ' CG ' ' HA ' ' A' ' 81' ' ' ARG . 13.4 mm-40 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.817 0.341 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.485 ' HA ' ' CG1' ' A' ' 27' ' ' VAL . 1.3 mm -130.35 168.15 23.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.606 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.4 OUTLIER 80.02 -166.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.441 ' NE2' ' OD1' ' A' ' 3' ' ' ASN . 2.2 mp0 -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 25' ' ' PHE . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.41 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.415 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.561 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.527 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.548 ' CG ' ' O ' ' A' ' 24' ' ' MET . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.606 HG13 ' N ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.412 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.445 HG11 ' CD2' ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.607 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.561 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.469 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.453 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.55 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 41' ' ' LYS . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.428 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.5 mm-40 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CE1' ' HB3' ' A' ' 48' ' ' GLU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.42 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.444 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.478 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.571 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.428 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.562 HG11 ' CZ ' ' B' ' 119' ' ' PHE . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.427 ' N ' HG21 ' A' ' 70' ' ' VAL . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.468 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.571 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' N ' ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.519 ' CB ' ' O ' ' A' ' 79' ' ' MET . 45.9 t30 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 1.9 t -50.57 141.58 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.7 p -141.85 118.77 11.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.529 ' CD2' ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -100.87 -170.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 53.67 29.7 9.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.117 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.132 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.1 OUTLIER -99.36 20.09 14.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.498 ' CG ' ' N ' ' B' ' 118' ' ' THR . 1.0 OUTLIER 83.25 -173.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.498 ' N ' ' CG ' ' B' ' 117' ' ' GLU . 0.2 OUTLIER 46.4 -151.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.575 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.96 -41.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' B' ' 123' ' ' TRP . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' B' ' 122' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp -37.52 121.73 0.93 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.468 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.78 64.77 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.654 2.236 . . . . 0.0 112.318 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.23 -33.67 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.883 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.752 0.31 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.471 ' HA ' ' CG2' ' A' ' 27' ' ' VAL . 4.8 mm 64.38 90.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.095 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.25 173.63 6.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.497 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.553 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.454 ' CD2' ' HA ' ' A' ' 21' ' ' GLN . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' HB2' ' N ' ' A' ' 37' ' ' TYR . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.516 ' HB3' ' CZ ' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.454 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.603 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.435 ' OG1' ' NZ ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.471 ' CG2' ' HA ' ' A' ' 2' ' ' ILE . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.467 ' CG1' HD11 ' A' ' 84' ' ' LEU . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.551 ' SD ' ' CE2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.421 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.503 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.6 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.609 ' O ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.609 ' NE2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.6 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.5 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.3 mm-40 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CE1' ' HG2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.533 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.565 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.601 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.471 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.471 ' CD2' ' HB3' ' A' ' 57' ' ' ASP . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.477 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.404 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.601 ' CD2' ' SG ' ' A' ' 54' ' ' CYS . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.426 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.466 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.438 ' N ' HG23 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.471 ' CE ' HD23 ' A' ' 80' ' ' LEU . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.474 HD21 ' CD1' ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.455 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 0.4 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.474 ' CD1' HD21 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.497 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 2.9 t -49.46 130.46 7.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.8 p -124.4 124.56 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.73 71.72 0.77 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.973 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 176.48 177.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.085 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.873 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.841 0.353 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.439 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER -122.16 -65.04 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.871 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 164.67 157.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.407 ' O ' ' C ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.83 -152.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.588 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.72 -42.2 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.908 -180.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' B' ' 125' ' ' LEU . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.588 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.456 ' CD2' ' O ' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -82.64 136.74 44.91 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -165.57 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.361 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.53 -39.94 1.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.481 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 35.2 mm -142.05 37.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.473 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 19.6 m120 -123.67 -174.77 3.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.529 ' CG1' ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.412 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.501 ' CD1' ' O ' ' A' ' 83' ' ' ASN . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.565 HD12 ' CD2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.463 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.413 ' CD1' ' CD1' ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.565 ' CD2' HD12 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.46 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.637 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.473 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.412 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.471 ' CG1' HD21 ' A' ' 84' ' ' LEU . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.477 ' HE3' ' CD1' ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.637 ' CZ ' ' CB ' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.46 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.41 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.429 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.487 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.524 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.4 mp0 -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' OE1' ' O ' ' B' ' 117' ' ' GLU . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.436 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 26.1 p-80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.512 HG12 ' CZ ' ' A' ' 68' ' ' PHE . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.464 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.426 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.491 ' CD2' ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.512 ' CZ ' HG12 ' A' ' 52' ' ' VAL . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.559 HG11 ' CE1' ' B' ' 119' ' ' PHE . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.558 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' A' ' 72' ' ' ASP . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' O ' HD11 ' A' ' 80' ' ' LEU . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.458 ' CD1' ' N ' ' A' ' 80' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.529 ' CD1' ' CG1' ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 10.8 t -83.31 149.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.0 p -128.55 120.51 26.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.154 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.9 38.94 2.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -142.09 169.47 17.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.12 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.147 -179.9 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.485 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER 69.71 122.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.918 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.485 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 1.0 OUTLIER 160.84 -85.9 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.414 HG23 ' N ' ' B' ' 119' ' ' PHE . 26.5 m -76.77 164.5 25.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.559 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -44.46 -51.53 8.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.481 ' CZ2' ' N ' ' A' ' 35' ' ' GLY . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.477 ' CD1' ' HE3' ' A' ' 31' ' ' MET . 0.5 OUTLIER -34.85 97.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.7 Cg_endo -69.73 -2.42 10.13 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.73 2.287 . . . . 0.0 112.324 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.403 ' O ' ' OH ' ' A' ' 77' ' ' TYR . 5.0 mm-40 63.27 -75.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.896 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' B' ' 127' ' ' PRO . 1.6 t-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.474 ' O ' ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.768 0.318 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.51 ' CG2' ' CD ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER 38.26 -162.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.494 ' N ' ' CG2' ' A' ' 27' ' ' VAL . 0.3 OUTLIER 170.7 -174.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.869 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.483 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.483 ' CG1' ' O ' ' A' ' 4' ' ' GLN . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.404 ' CB ' HG13 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.494 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.421 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.472 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.47 ' HB3' ' CB ' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.472 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.495 ' CB ' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.47 ' CB ' ' HB3' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.606 ' CD1' ' C ' ' A' ' 24' ' ' MET . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.489 ' O ' ' CG2' ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.494 ' CG2' ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.51 ' CD ' ' CG2' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.535 ' CG1' ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.474 ' HE2' ' CD1' ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.495 ' CG ' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.413 HD13 ' CG2' ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.568 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.455 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.521 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.6 mp0 -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.484 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.4 mm-40 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.702 ' CE1' ' CD2' ' B' ' 122' ' ' LEU . 14.0 m80 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.527 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.436 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.436 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.495 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.461 HD21 ' CB ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.527 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.411 HG11 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.6 ' HE2' ' CE1' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.492 ' OH ' ' CB ' ' B' ' 128' ' ' GLU . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.514 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.424 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.522 ' CB ' ' O ' ' A' ' 79' ' ' MET . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CD2' ' CG1' ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.409 ' O ' ' CB ' ' A' ' 5' ' ' VAL . 3.1 t -37.37 139.05 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 14.1 p -138.68 138.54 37.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.1 mp -121.42 -54.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 76.93 105.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.142 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.106 -179.898 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.811 0.338 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.14 114.9 17.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.42 166.44 24.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.888 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.452 ' CG2' ' N ' ' B' ' 119' ' ' PHE . 4.9 t -173.24 -153.07 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 4.2 t80 -41.87 -27.76 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.702 ' CD2' ' CE1' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.605 ' CE3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.605 HD11 ' CE3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER -35.35 113.51 0.49 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' B' ' 128' ' ' GLU . 53.9 Cg_endo -69.76 64.67 1.81 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.711 2.274 . . . . 0.0 112.328 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.492 ' CB ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -37.8 -33.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.842 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.789 0.328 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.413 HD12 ' N ' ' A' ' 2' ' ' ILE . 2.6 mm 65.27 43.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.147 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.484 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -87.38 132.6 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.484 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.5 ' CG1' ' O ' ' A' ' 85' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.484 ' HG ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.484 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.42 HD12 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.426 ' NE2' ' HA ' ' A' ' 21' ' ' GLN . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.558 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.455 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.6 ' CD1' ' C ' ' A' ' 24' ' ' MET . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.47 HG11 ' CD2' ' A' ' 84' ' ' LEU . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.452 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.608 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.443 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.42 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.592 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.433 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.457 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.522 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.9 mp0 -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.475 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.5 mm-40 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.537 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.415 ' OE1' ' C ' ' B' ' 117' ' ' GLU . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.537 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 1.4 p-80 -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.491 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.569 HG13 ' CZ ' ' A' ' 68' ' ' PHE . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.461 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.461 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.523 HD12 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG13 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.471 ' CG2' HD21 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.52 ' CB ' ' O ' ' A' ' 79' ' ' MET . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.475 ' HB2' ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 3.6 t -37.66 137.41 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.6 p -136.17 120.73 18.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.3 mp -109.73 133.21 53.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 56.06 103.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.097 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' SER . . . . . 0.435 ' N ' ' OE2' ' B' ' 117' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.837 0.351 . . . . 0.0 110.93 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -106.21 123.64 48.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.93 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.435 ' OE2' ' N ' ' B' ' 115' ' ' SER . 0.0 OUTLIER -169.27 128.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.859 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.406 HG22 ' N ' ' B' ' 119' ' ' PHE . 90.3 m -51.52 150.44 3.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.144 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -45.38 -56.95 4.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.471 HD21 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.452 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.6 mp -58.82 109.78 2.13 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.545 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.8 Cg_endo -69.75 62.09 1.75 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.655 2.237 . . . . 0.0 112.373 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' B' ' 127' ' ' PRO . 0.5 OUTLIER 34.37 -90.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.545 ' N ' ' O ' ' B' ' 127' ' ' PRO . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.542 ' CD1' ' N ' ' A' ' 2' ' ' ILE . 0.4 OUTLIER 55.05 107.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.137 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.7 OUTLIER -121.2 122.46 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.474 HG22 ' CG2' ' A' ' 30' ' ' VAL . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.487 ' O ' ' CG1' ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.468 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.416 HD23 ' CG2' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.567 HD13 ' CD2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.42 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.565 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.567 ' CD2' HD13 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.43 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.569 ' HB2' ' CD1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.477 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.595 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.468 HG23 ' CG2' ' A' ' 2' ' ' ILE . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.466 ' N ' ' O ' ' A' ' 3' ' ' ASN . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' NZ ' ' CG2' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.509 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.474 ' CG2' HG22 ' A' ' 5' ' ' VAL . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.423 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.569 ' CD1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.43 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB3' ' A' ' 18' ' ' ALA . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.424 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.456 ' CB ' HD13 ' A' ' 43' ' ' LEU . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.463 HD11 ' CB ' ' A' ' 57' ' ' ASP . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.765 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.7 OUTLIER -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.612 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.1 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.405 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.565 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.461 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.463 ' CB ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.535 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.461 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.544 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.417 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.415 ' O ' ' SG ' ' A' ' 54' ' ' CYS . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.565 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.461 HG13 ' CE1' ' B' ' 119' ' ' PHE . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.46 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.477 HD23 ' CE ' ' A' ' 31' ' ' MET . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.429 ' CZ ' ' HB2' ' B' ' 129' ' ' ASN . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.544 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 3.6 t30 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.47 HD11 ' CG1' ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.487 ' CG1' ' O ' ' A' ' 6' ' ' ARG . 73.3 t -47.25 91.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.439 ' N ' ' O ' ' A' ' 84' ' ' LEU . 71.6 p -114.89 139.45 49.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.8 35.99 3.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.895 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 -171.1 3.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.097 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.155 -179.866 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.805 0.336 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 71.52 124.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.927 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.61 -156.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.956 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.415 HG23 ' N ' ' B' ' 119' ' ' PHE . 24.9 m -42.4 165.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.568 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER -48.27 -30.15 4.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.915 179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.439 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.6 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.6 ' CD2' ' CZ3' ' B' ' 123' ' ' TRP . 11.1 tp -50.58 112.3 2.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 157.69 59.5 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.77 -36.39 10.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.429 ' HB2' ' CZ ' ' A' ' 77' ' ' TYR . 2.7 m120 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.467 ' HA ' ' CG1' ' A' ' 27' ' ' VAL . 1.5 pp -124.57 102.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.17 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.49 ' N ' HG11 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -97.54 168.23 10.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.495 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.517 ' CG2' ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.44 ' CB ' HG12 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.471 ' O ' ' CD2' ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.568 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.577 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.568 ' CD2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.435 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB3' ' CD1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' A' ' 24' ' ' MET . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.49 HG11 ' N ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.551 ' SD ' ' CE2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.427 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.577 ' CD2' ' HB3' ' A' ' 15' ' ' LEU . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.435 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.587 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.432 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' CD1' HD22 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.587 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.522 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.467 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.9 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.453 ' CG ' ' HA ' ' B' ' 118' ' ' THR . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.496 ' CD2' ' HG2' ' A' ' 51' ' ' MET . 2.1 p-80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.496 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.666 ' CG1' ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.449 ' N ' HG22 ' A' ' 52' ' ' VAL . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.518 ' CB ' ' CD1' ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.518 ' CD1' ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.491 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.474 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.433 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.666 ' CD1' ' CG1' ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.475 ' CG2' ' N ' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.475 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.418 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.479 HD23 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.475 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 79' ' ' MET . 44.4 t30 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.475 ' CD2' ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.44 HG12 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER -41.58 145.49 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.8 p -140.08 135.45 32.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.25 155.81 26.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.938 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.04 88.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.117 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 -179.841 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.794 0.33 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -163.39 146.21 10.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.6 151.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.923 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.494 ' CG2' ' N ' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -172.54 -173.43 1.03 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.714 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -45.01 -48.3 11.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.423 ' O ' ' C ' ' B' ' 123' ' ' TRP . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.502 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.502 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.89 107.62 0.86 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.422 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.6 Cg_endo -69.77 -6.78 19.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.229 . . . . 0.0 112.349 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' B' ' 127' ' ' PRO . 0.2 OUTLIER 78.81 -3.24 2.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.905 -179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.788 0.327 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.493 ' CD1' ' OE1' ' B' ' 128' ' ' GLU . 5.6 mm 70.64 99.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.499 HD21 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -111.91 132.23 54.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.883 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.499 ' N ' HD21 ' A' ' 3' ' ' ASN . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.473 ' HB ' ' CD1' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.411 ' N ' HG21 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.413 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.482 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.414 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.569 HD23 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.562 ' HB3' ' CD2' ' A' ' 33' ' ' TYR . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.419 ' HB2' ' N ' ' A' ' 37' ' ' TYR . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.519 ' CB ' ' CZ ' ' A' ' 33' ' ' TYR . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG22 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' NZ ' HG21 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.433 ' CG2' HG22 ' A' ' 5' ' ' VAL . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.435 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.596 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.4 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' N ' ' HB2' ' A' ' 18' ' ' ALA . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.469 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' N ' HG11 ' A' ' 40' ' ' VAL . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.53 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.416 HD21 ' N ' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.472 ' CB ' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 7.1 mm-40 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.57 ' CD2' ' HE3' ' A' ' 71' ' ' LYS . 2.0 p-80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.504 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.47 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.447 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.566 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.497 ' CG2' ' HA ' ' A' ' 50' ' ' HIS . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.57 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.59 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.569 ' HD2' ' O ' ' A' ' 72' ' ' ASP . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.481 ' CD2' HD21 ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.59 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.548 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.473 ' CD1' ' HB ' ' A' ' 5' ' ' VAL . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.419 ' O ' ' C ' ' A' ' 86' ' ' THR . 0.4 OUTLIER -73.91 -5.14 6.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 85' ' ' VAL . 5.6 p 36.14 -155.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.131 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.465 ' CD1' ' HB2' ' A' ' 4' ' ' GLN . 2.2 mt -104.83 -57.24 2.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.905 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -101.55 143.02 32.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.131 -179.888 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.08 77.17 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.933 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.486 ' O ' ' CB ' ' B' ' 118' ' ' THR . 21.2 tt0 73.29 -65.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.486 ' CB ' ' O ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER 159.13 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.141 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.563 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER -50.31 -47.12 55.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.451 ' O ' ' CD ' ' B' ' 127' ' ' PRO . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.481 HD21 ' CD2' ' A' ' 76' ' ' LEU . 5.3 mp -106.12 73.45 0.29 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.7 Cg_endo -69.77 -24.78 29.22 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 0.0 112.338 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' B' ' 127' ' ' PRO . 0.0 OUTLIER 158.1 -31.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.502 ' CA ' ' OH ' ' A' ' 77' ' ' TYR . 3.5 m120 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ILE . 10.8 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.444 HD13 ' CG2' ' A' ' 26' ' ' THR . 0.9 OUTLIER -50.9 -175.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.472 ' H ' ' CG2' ' A' ' 27' ' ' VAL . 0.1 OUTLIER -171.12 130.46 0.76 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.471 ' N ' HD21 ' A' ' 3' ' ' ASN . 2.3 mp0 -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.454 HG23 ' CG2' ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.443 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.477 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.469 HD11 ' CD2' ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.477 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.469 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.444 ' CG2' HD13 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.472 ' CG2' ' H ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.454 ' CG2' HG23 ' A' ' 5' ' ' VAL . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.585 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.517 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.469 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.598 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.423 HG11 ' N ' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.491 ' CB ' ' CD2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.491 ' CD2' ' CB ' ' A' ' 41' ' ' LYS . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.514 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.2 mp0 -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.484 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.6 mm-40 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.43 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.594 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 2.8 p-80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.504 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.469 ' CD2' HD11 ' A' ' 14' ' ' ILE . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 60' ' ' GLY . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.422 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.545 ' HB3' ' CD ' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.545 ' CD ' ' HB3' ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.504 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.468 ' CG1' HG21 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 80' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.457 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.483 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.457 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.431 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.523 ' O ' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 86' ' ' THR . 0.9 OUTLIER -89.3 152.89 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.423 ' N ' HG12 ' A' ' 85' ' ' VAL . 0.8 OUTLIER -151.56 116.72 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.146 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.483 ' CD2' ' N ' ' A' ' 87' ' ' LEU . 0.1 OUTLIER -102.25 85.18 2.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -163.01 -177.7 5.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.063 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.107 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' GLN . . . . . 0.474 ' NE2' ' N ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER -74.57 121.28 21.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.911 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' GLU . . . . . 0.474 ' N ' ' NE2' ' B' ' 116' ' ' GLN . 16.2 tp10 -167.15 -49.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' THR . . . . . 0.53 ' CG2' ' N ' ' B' ' 119' ' ' PHE . 3.1 t -179.54 -151.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' PHE . . . . . 0.582 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -37.89 -42.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 118' ' ' THR . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.419 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -37.76 136.45 0.74 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' PRO . . . . . 0.476 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.3 Cg_endo -69.7 -22.45 32.34 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.663 2.242 . . . . 0.0 112.327 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' GLU . . . . . 0.474 ' CG ' ' C ' ' B' ' 127' ' ' PRO . 0.6 OUTLIER 64.12 -73.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.9 -179.966 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' ASN . . . . . 0.448 ' N ' ' O ' ' B' ' 127' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.911 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.799 0.333 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 6' ' ' ARG . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.476 ' N ' HG23 ' A' ' 5' ' ' VAL . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.751 ' HE2' HG21 ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.428 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.612 HD11 ' NE2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.766 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.612 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 1.027 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.766 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.481 ' HE3' ' CB ' ' A' ' 26' ' ' THR . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.123 HG11 HD11 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.702 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 1.027 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.43 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.59 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.59 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 1.3 mp0 -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.7 mm100 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.82 HG23 HG12 ' A' ' 70' ' ' VAL . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.825 ' HA ' HD21 ' A' ' 59' ' ' LEU . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.819 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.483 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.64 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.82 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.563 ' HE2' HD22 ' B' ' 122' ' ' LEU . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.74 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.123 HD11 HG11 ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 8' ' ' LYS . 9.0 t . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.563 HD22 ' HE2' ' A' ' 71' ' ' LYS . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.554 HD13 ' CG ' ' A' ' 71' ' ' LYS . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.74 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.662 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.2 t-20 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 1.6 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.545 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.731 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.715 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.731 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.715 ' CD2' HD22 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.748 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.762 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.419 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.895 ' O ' HG22 ' A' ' 5' ' ' VAL . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.703 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.865 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.762 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.748 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 52' ' ' VAL . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.488 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 0.8 OUTLIER -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.63 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.974 HG23 HG12 ' A' ' 70' ' ' VAL . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.545 ' N ' HG12 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.553 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.488 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 58' ' ' LEU . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.748 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.623 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.974 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.623 ' SD ' HD12 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.844 HD23 ' OD1' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.844 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.722 ' CD2' HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.545 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.576 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.485 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.949 ' O ' HD12 ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.949 HD12 ' O ' ' B' ' 123' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.661 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.761 0.315 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.006 HG22 ' O ' ' A' ' 25' ' ' PHE . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.799 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.766 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.766 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.672 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 1.006 ' O ' HG22 ' A' ' 5' ' ' VAL . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.004 ' CG2' HG21 ' A' ' 5' ' ' VAL . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.484 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.672 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.403 ' O ' HG12 ' A' ' 40' ' ' VAL . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.702 ' CD1' HD21 ' A' ' 59' ' ' LEU . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.43 ' CE2' ' NE2' ' A' ' 46' ' ' GLN . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.43 ' NE2' ' CE2' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.497 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.858 HG23 HG12 ' A' ' 70' ' ' VAL . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.552 ' CB ' HD12 ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 43' ' ' LEU . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.858 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.536 ' HE2' HD21 ' B' ' 122' ' ' LEU . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.7 ' CD2' HD23 ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.62 ' O ' HD21 ' A' ' 11' ' ' LEU . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.865 ' HG ' HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.799 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.6 t . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.627 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 2.9 t80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.536 HD21 ' HE2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.792 HD11 ' O ' ' A' ' 70' ' ' VAL . 2.6 mp . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.462 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.054 HG11 HD22 ' A' ' 84' ' ' LEU . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.534 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.516 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.685 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.434 ' CD2' ' HA ' ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.898 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.434 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.807 ' O ' HG22 ' A' ' 5' ' ' VAL . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.772 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.059 HG11 HD21 ' A' ' 84' ' ' LEU . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.794 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.898 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.527 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.74 HG23 HG12 ' A' ' 70' ' ' VAL . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.514 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.496 ' HB2' HD21 ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.749 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.749 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.481 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.433 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.735 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.74 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HZ1' ' CE1' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.788 HD22 HD21 ' B' ' 126' ' ' LEU . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.486 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.798 HD22 ' CD1' ' A' ' 84' ' ' LEU . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.059 HD21 HG11 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.602 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.602 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.794 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.2 tp . . . . . 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.522 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.755 0.312 . . . . 0.0 110.948 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.713 ' O ' HG21 ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD3' HG13 ' A' ' 5' ' ' VAL . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.587 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.768 ' CD2' HD22 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.714 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.976 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 26' ' ' THR . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.631 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.714 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.569 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.57 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HG2' ' OD1' ' A' ' 45' ' ' ASP . 1.9 mm100 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.488 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.451 ' O ' HG11 ' A' ' 70' ' ' VAL . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.707 ' HB3' HD13 ' B' ' 122' ' ' LEU . 13.4 p80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.983 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.625 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.801 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.801 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.983 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.939 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.484 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.593 HD21 ' CE ' ' A' ' 31' ' ' MET . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.019 HD22 ' CD2' ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.668 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD2' HD22 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.752 ' O ' HG22 ' A' ' 5' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.896 0.379 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.812 HD12 ' CG2' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.562 ' O ' HD12 ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.536 ' O ' HD23 ' B' ' 125' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.631 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.0 t30 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.803 0.335 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.77 HG21 HG21 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.784 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HD3' HG13 ' A' ' 5' ' ' VAL . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.887 HD11 ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.716 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.893 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.438 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.993 ' CG1' HD21 ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.944 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.444 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.893 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 119' ' ' PHE . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.493 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.705 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.705 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.508 ' OE1' ' CD2' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.941 ' HB3' HD13 ' B' ' 122' ' ' LEU . 9.9 p80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.936 HG23 HG12 ' A' ' 70' ' ' VAL . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.767 ' HA ' HD21 ' A' ' 59' ' ' LEU . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.829 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.829 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.637 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.936 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.798 ' CD ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.422 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.494 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HG ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.887 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.993 HD21 ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.784 HG11 ' HB3' ' A' ' 6' ' ' ARG . 2.3 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.862 0.363 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.775 0.321 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.593 ' OE1' HG23 ' A' ' 26' ' ' THR . 13.1 mm-40 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.471 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.549 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.764 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.643 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.764 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.931 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.466 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.778 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 26' ' ' THR . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.751 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.544 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.931 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 58' ' ' LEU . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 1.009 HD13 HD21 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.762 ' HB3' HD13 ' B' ' 122' ' ' LEU . 22.4 p80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.954 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.475 ' O ' HD22 ' A' ' 43' ' ' LEU . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.557 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.651 ' H ' HD22 ' A' ' 58' ' ' LEU . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 1.009 HD21 HD13 ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.954 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.703 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.823 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.751 HD21 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 76' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.43 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.539 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.823 HD22 ' CE ' ' A' ' 71' ' ' LYS . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.544 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.417 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.0 t-20 . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.813 0.339 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 30' ' ' VAL . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.508 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.481 ' HA ' HD23 ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.519 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.798 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.73 ' CD2' HD22 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 1.044 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.798 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.449 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 27' ' ' VAL . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 84' ' ' LEU . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.944 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.562 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 30' ' ' VAL . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 1.044 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.606 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.769 ' O ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.594 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 2.1 mm100 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.685 ' HB3' HD13 ' B' ' 122' ' ' LEU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.453 ' HE1' ' O ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 43' ' ' LEU . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.456 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.535 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.794 HD11 ' HB2' ' A' ' 83' ' ' ASN . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.681 HD21 ' HB2' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.532 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.681 ' HB2' HD21 ' A' ' 63' ' ' LEU . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.821 HD22 HD21 ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.41 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.523 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.026 HD23 ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 1.026 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.768 ' O ' HG12 ' A' ' 85' ' ' VAL . 7.3 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.892 0.377 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.45 ' C ' HD23 ' B' ' 122' ' ' LEU . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.793 HD23 ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' HE1' ' A' ' 31' ' ' MET . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.764 0.316 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.786 HG21 ' CD1' ' A' ' 84' ' ' LEU . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.662 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.496 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.652 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.637 ' O ' HD22 ' A' ' 15' ' ' LEU . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.669 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.706 ' NE2' HD11 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.819 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.462 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.894 HG11 ' CG ' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.672 ' HE3' HD12 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.407 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.819 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.541 HD13 HG21 ' A' ' 52' ' ' VAL . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.586 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.708 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.404 ' HG2' ' C ' ' A' ' 41' ' ' LYS . 4.5 mm100 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.708 HD21 ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.586 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.608 ' HA ' HG22 ' A' ' 70' ' ' VAL . 35.1 p80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG12 ' A' ' 70' ' ' VAL . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.859 ' HA ' HD21 ' A' ' 59' ' ' LEU . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.455 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 58' ' ' LEU . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.875 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.875 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.48 HD22 ' HA ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.958 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.622 ' CE ' HD22 ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' ASN . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 76' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.528 ' O ' HD13 ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.894 ' CG ' HG11 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.847 0.356 . . . . 0.0 110.87 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.622 HD22 ' CE ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.672 HD12 ' HE3' ' A' ' 31' ' ' MET . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.739 0.305 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.688 ' OE1' HG23 ' A' ' 26' ' ' THR . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.863 HG21 HG21 ' A' ' 30' ' ' VAL . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.464 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.724 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.724 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.795 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' HD11 ' A' ' 12' ' ' LEU . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.655 ' O ' HG22 ' A' ' 5' ' ' VAL . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.688 HG23 ' OE1' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.979 HG21 HD11 ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.526 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.417 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.795 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.543 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.686 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.686 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.7 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.614 ' HA ' HG22 ' A' ' 70' ' ' VAL . 4.3 p80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.573 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.768 HG23 ' CG1' ' A' ' 70' ' ' VAL . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.557 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.822 ' HA ' HD21 ' A' ' 59' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.834 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.834 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.436 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.683 HD21 ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.677 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.768 ' CG1' HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HZ1' ' CD2' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.635 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.683 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 84' ' ' LEU . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.979 HD11 HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.761 ' O ' HG12 ' A' ' 85' ' ' VAL . 3.3 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.856 0.36 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' B' ' 121' ' ' ASP . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.635 HD11 ' HB3' ' A' ' 73' ' ' PRO . 6.3 tp . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.599 ' O ' HG22 ' A' ' 26' ' ' THR . 2.3 m-20 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.753 0.311 . . . . 0.0 110.951 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' C ' HG13 ' A' ' 5' ' ' VAL . 5.7 mm100 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.033 HG22 ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.636 ' H ' HG12 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.71 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.732 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.71 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.732 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.928 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 1.033 ' O ' HG22 ' A' ' 5' ' ' VAL . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.599 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.025 HG11 HD11 ' A' ' 84' ' ' LEU . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.953 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.765 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.928 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.514 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.604 ' HB3' HD23 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.636 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.636 HD22 ' C ' ' A' ' 42' ' ' GLN . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.895 ' HB3' HD23 ' B' ' 122' ' ' LEU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.453 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.609 HG23 ' CG1' ' A' ' 70' ' ' VAL . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.77 HD21 ' CG ' ' A' ' 83' ' ' ASN . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.69 ' O ' HD13 ' B' ' 126' ' ' LEU . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.527 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.712 HD22 HD21 ' B' ' 126' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.604 ' SD ' HD12 ' A' ' 63' ' ' LEU . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.553 ' HG ' HD23 ' A' ' 84' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.77 ' CG ' HD21 ' A' ' 62' ' ' LEU . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.025 HD11 HG11 ' A' ' 30' ' ' VAL . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.473 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.857 0.36 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.421 ' HB3' HD13 ' B' ' 122' ' ' LEU . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.895 HD23 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.953 HD23 ' CE ' ' A' ' 31' ' ' MET . 6.4 tp . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.645 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 0.0 110.901 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.911 HG21 HG21 ' A' ' 30' ' ' VAL . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.435 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 HG13 ' A' ' 30' ' ' VAL . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.782 ' O ' HG22 ' A' ' 5' ' ' VAL . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.083 HG11 HD21 ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.748 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.742 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.672 ' OH ' HD23 ' A' ' 58' ' ' LEU . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 HG21 ' A' ' 52' ' ' VAL . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.488 ' HE2' ' O ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.625 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.625 HD12 ' C ' ' A' ' 42' ' ' GLN . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.412 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.733 ' HB3' HD13 ' B' ' 122' ' ' LEU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.521 HG21 HD13 ' A' ' 38' ' ' ILE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.624 ' CG ' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.672 HD23 ' OH ' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.531 HD21 HD22 ' A' ' 43' ' ' LEU . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.494 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.467 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.77 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.848 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.424 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.748 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.424 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.77 ' HG3' HD22 ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.712 HD22 HD23 ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.519 ' CB ' ' O ' ' A' ' 79' ' ' MET . 17.3 t-20 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.083 HD21 HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 5' ' ' VAL . 1.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.577 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.848 HD22 ' CE ' ' A' ' 71' ' ' LYS . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.674 ' O ' HD23 ' B' ' 125' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 0.0 110.882 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.522 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.712 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' CD2' HD22 ' A' ' 12' ' ' LEU . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.831 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.563 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.836 ' O ' HG22 ' A' ' 5' ' ' VAL . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.413 HG23 ' H ' ' A' ' 27' ' ' VAL . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.7 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.415 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.831 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.611 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.474 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.459 ' OE1' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.611 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.684 ' HA ' HG22 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.574 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.495 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.74 HD13 ' OE2' ' A' ' 61' ' ' GLU . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.74 ' OE2' HD13 ' A' ' 58' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.574 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.684 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.544 ' NZ ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.7 HD21 ' CE ' ' A' ' 31' ' ' MET . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.437 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.902 HD22 HD13 ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.737 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.902 HD13 HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.695 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.9 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.591 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.879 0.371 . . . . 0.0 110.908 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 50' ' ' HIS . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.681 HD11 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 27' ' ' VAL . 79.6 m-20 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.779 0.323 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.019 HG11 ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.523 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.737 ' O ' HD22 ' A' ' 15' ' ' LEU . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.523 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.555 ' CD1' HD13 ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.737 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.97 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.705 ' O ' HG22 ' A' ' 5' ' ' VAL . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.411 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.58 HG21 HG21 ' A' ' 5' ' ' VAL . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.736 ' HE2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.97 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.514 HD13 HG21 ' A' ' 52' ' ' VAL . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.662 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.662 HD12 ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB3' HD11 ' B' ' 122' ' ' LEU . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.642 ' HA ' HG22 ' A' ' 70' ' ' VAL . 22.3 p80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.71 HG23 HG12 ' A' ' 70' ' ' VAL . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.597 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 14' ' ' ILE . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.62 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.438 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.582 HD12 ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.62 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.62 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.902 HG21 HD12 ' B' ' 122' ' ' LEU . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.494 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.62 ' O ' HD21 ' A' ' 63' ' ' LEU . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.736 HD21 ' HE2' ' A' ' 31' ' ' MET . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.507 ' SD ' HD12 ' A' ' 63' ' ' LEU . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.875 ' HG ' HD23 ' A' ' 84' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HD3' HD12 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD1' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.73 ' O ' HG12 ' A' ' 5' ' ' VAL . 10.8 t . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.473 ' O ' ' N ' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.839 0.352 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.902 HD12 HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.642 ' O ' HD23 ' B' ' 126' ' ' LEU . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.642 HD23 ' O ' ' B' ' 123' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.674 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.808 0.337 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.627 ' OE1' HG23 ' A' ' 26' ' ' THR . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.992 HG22 ' O ' ' A' ' 25' ' ' PHE . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.473 ' CB ' HG11 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.533 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.509 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.769 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.509 ' NE2' HD11 ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.994 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.769 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.992 ' O ' HG22 ' A' ' 5' ' ' VAL . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 1.033 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.674 HG23 ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.058 HG11 ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.82 ' CE ' HD13 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.518 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.994 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.459 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.4 mm100 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 1.155 ' CD2' HD21 ' B' ' 122' ' ' LEU . 34.5 m-70 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.589 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.74 ' HA ' HD21 ' A' ' 59' ' ' LEU . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.412 ' H ' ' CD2' ' A' ' 58' ' ' LEU . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.744 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.526 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.409 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.589 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.897 HD22 HD12 ' A' ' 84' ' ' LEU . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.44 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.526 ' OD1' HD12 ' A' ' 62' ' ' LEU . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.058 ' CD2' HG11 ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 4.2 t80 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.89 0.376 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 1.155 HD21 ' CD2' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.848 ' CZ3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.848 HD11 ' CZ3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 30' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.624 HD23 ' N ' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.631 HD11 ' O ' ' A' ' 83' ' ' ASN . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.674 ' N ' HD13 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.463 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' HB2' ' A' ' 37' ' ' TYR . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.793 ' O ' HG22 ' A' ' 5' ' ' VAL . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.83 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.512 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 5' ' ' VAL . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.632 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.429 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.439 HG21 HG13 ' A' ' 52' ' ' VAL . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.602 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.602 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.5 mm100 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.43 ' O ' HG11 ' A' ' 70' ' ' VAL . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.617 ' CD2' ' HG2' ' A' ' 48' ' ' GLU . 0.7 OUTLIER -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.504 ' HE2' ' C ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 70' ' ' VAL . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.881 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.881 HD21 ' HA ' ' A' ' 54' ' ' CYS . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.732 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.523 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.603 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.815 ' CG2' HD23 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.793 ' HD3' HD11 ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.747 ' CD2' HD23 ' A' ' 84' ' ' LEU . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.631 ' O ' HD11 ' A' ' 11' ' ' LEU . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.809 HD21 ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.61 ' O ' HG12 ' A' ' 5' ' ' VAL . 3.6 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.832 0.349 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.815 HD23 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.737 HD11 ' O ' ' A' ' 70' ' ' VAL . 1.6 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.816 0.341 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.922 HG22 ' O ' ' A' ' 25' ' ' PHE . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.708 ' O ' HG11 ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.694 HD22 HG23 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.804 HD11 ' NE2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.804 ' NE2' HD11 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.425 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.922 ' O ' HG22 ' A' ' 5' ' ' VAL . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.598 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 28' ' ' LYS . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.599 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.528 ' N ' ' HD3' ' A' ' 28' ' ' LYS . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.893 HG11 ' CD1' ' A' ' 84' ' ' LEU . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.779 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 59' ' ' LEU . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.434 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 41' ' ' LYS . 0.8 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.83 HD13 ' CD2' ' A' ' 59' ' ' LEU . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG11 ' A' ' 70' ' ' VAL . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.731 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.601 ' HA ' HD21 ' A' ' 59' ' ' LEU . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.458 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.851 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.455 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.527 HD12 ' HB2' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.7 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.851 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.748 ' O ' HD13 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.623 HD22 HD21 ' B' ' 126' ' ' LEU . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.7 ' HG3' HD22 ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.527 ' HB2' HD12 ' A' ' 62' ' ' LEU . 5.0 t-20 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.893 ' CD1' HG11 ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.708 HG11 ' O ' ' A' ' 6' ' ' ARG . 73.3 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.573 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.886 0.374 . . . . 0.0 110.915 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.63 ' CZ3' HD22 ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.748 HD13 ' O ' ' A' ' 70' ' ' VAL . 11.1 tp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.776 0.322 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 1.026 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.549 ' CB ' HG11 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.537 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.769 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.769 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.973 ' O ' HG22 ' A' ' 5' ' ' VAL . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.43 ' H ' HG12 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.425 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.026 ' CG2' HG21 ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.775 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.851 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.952 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 43' ' ' LEU . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.597 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.665 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.665 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.583 ' O ' HG11 ' A' ' 70' ' ' VAL . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.447 ' C ' HG13 ' A' ' 70' ' ' VAL . 1.6 p80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.493 ' HE1' ' O ' ' A' ' 68' ' ' PHE . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.849 HG11 ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' SER . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.686 ' CB ' HD11 ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.5 ' OD1' HD21 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.686 HD11 ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.645 HD12 ' ND2' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.484 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.849 ' CD1' HG11 ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.706 ' O ' HD11 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.847 ' HE2' HD22 ' B' ' 122' ' ' LEU . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.775 HD21 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.94 ' CD2' HD23 ' A' ' 84' ' ' LEU . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.645 ' ND2' HD12 ' A' ' 62' ' ' LEU . 12.7 t-20 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.94 HD23 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.549 HG11 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.714 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.892 0.377 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.847 HD22 ' HE2' ' A' ' 71' ' ' LYS . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.58 ' HD2' HD23 ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.722 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.576 HG11 HD11 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.505 ' N ' HG23 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.668 ' HG3' HD12 ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.513 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.742 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.746 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.742 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.746 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.756 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.419 ' H ' HG23 ' A' ' 27' ' ' VAL . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.404 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.854 HG11 HD21 ' A' ' 84' ' ' LEU . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.687 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.892 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.932 HD13 HG21 ' A' ' 52' ' ' VAL . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' CE ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.462 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.523 ' HB3' HD23 ' A' ' 43' ' ' LEU . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.523 HD23 ' HB3' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.704 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.932 HG21 HD13 ' A' ' 38' ' ' ILE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' ND2' ' A' ' 83' ' ' ASN . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.708 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.916 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.546 ' HE2' ' CG ' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.617 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.795 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.617 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 HD23 ' A' ' 84' ' ' LEU . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.912 HD23 HD22 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.568 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.432 ' O ' HD13 ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.441 HD13 ' H ' ' B' ' 125' ' ' LEU . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.812 HD11 ' O ' ' A' ' 70' ' ' VAL . 5.3 mp . . . . . 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.612 HG21 HG21 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.45 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.459 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 83' ' ' ASN . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.445 HD11 HD21 ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.699 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.971 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.793 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.679 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 26' ' ' THR . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.724 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.408 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.793 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.971 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.534 HD13 HG11 ' A' ' 52' ' ' VAL . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.609 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.549 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.604 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.604 HD22 ' C ' ' A' ' 42' ' ' GLN . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.609 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.474 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.1 mm100 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.551 ' N ' HD23 ' B' ' 122' ' ' LEU . 1.2 p80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.955 HG23 HG12 ' A' ' 70' ' ' VAL . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.464 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 58' ' ' LEU . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.483 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD22 ' HD3' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.638 ' HD3' HD22 ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.955 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.407 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.662 HD22 HD21 ' B' ' 126' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 76' ' ' LEU . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.47 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.627 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.025 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' PHE . . . . . 0.582 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 122' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.724 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 2' ' ' ILE . 52.9 mm-40 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.794 0.33 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 27' ' ' VAL . 1.4 pp -37.6 111.45 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.148 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.46 174.56 5.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 6' ' ' ARG . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.476 ' N ' HG23 ' A' ' 5' ' ' VAL . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.751 ' HE2' HG21 ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.428 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.612 HD11 ' NE2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.766 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.612 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 1.027 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.766 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.878 HG21 ' HA ' ' A' ' 2' ' ' ILE . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.634 ' CD ' HD13 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.123 HG11 HD11 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.702 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 1.027 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.43 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.59 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.59 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 1.3 mp0 -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.7 mm100 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.82 HG23 HG12 ' A' ' 70' ' ' VAL . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.825 ' HA ' HD21 ' A' ' 59' ' ' LEU . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.819 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.483 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.64 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.82 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.563 ' HE2' HD22 ' B' ' 122' ' ' LEU . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.74 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.123 HD11 HG11 ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 8' ' ' LYS . 9.0 t -61.17 99.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 84' ' ' LEU . 18.0 p -99.27 161.87 13.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.157 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -119.41 173.22 7.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.567 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 75.97 37.98 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.092 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -88.49 142.32 27.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.947 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.4 OUTLIER -132.67 -72.99 0.51 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.877 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.88 -152.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.125 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -37.54 -43.55 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' B' ' 118' ' ' THR . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.563 HD22 ' HE2' ' A' ' 71' ' ' LYS . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.554 HD13 ' CG ' ' A' ' 71' ' ' LYS . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.74 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -42.6 102.59 0.28 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 91.62 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.692 2.261 . . . . 0.0 112.373 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -38.32 -33.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.942 ' O ' HG11 ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.795 0.331 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.772 HD11 ' C ' ' B' ' 128' ' ' GLU . 45.8 mm -130.9 40.34 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.662 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.2 t-20 -114.54 -168.89 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.883 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 1.6 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.545 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.731 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.715 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.731 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.715 ' CD2' HD22 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.748 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.762 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.419 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.895 ' O ' HG22 ' A' ' 5' ' ' VAL . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.703 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.942 HG11 ' O ' ' A' ' 1' ' ' GLN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.865 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.762 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.748 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 52' ' ' VAL . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.488 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 0.8 OUTLIER -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.63 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.974 HG23 HG12 ' A' ' 70' ' ' VAL . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.545 ' N ' HG12 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.553 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.488 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 58' ' ' LEU . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.748 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.623 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.974 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.623 ' SD ' HD12 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.844 HD23 ' OD1' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.844 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.722 ' CD2' HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.545 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t -44.9 135.85 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 13.6 p -134.9 140.24 45.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.14 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.65 50.3 0.88 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.14 19.1 9.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.056 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.09 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 89.9 p . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.779 0.324 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 59.99 14.83 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.631 ' C ' HG22 ' B' ' 118' ' ' THR . 1.5 mm-40 -114.05 148.92 36.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.884 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.724 HG23 ' H ' ' B' ' 119' ' ' PHE . 0.1 OUTLIER 160.68 -65.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.155 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.724 ' H ' HG23 ' B' ' 118' ' ' THR . 0.6 OUTLIER -64.14 -39.57 94.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.485 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.949 ' O ' HD12 ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.949 HD12 ' O ' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -37.82 124.02 0.99 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.477 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.77 66.87 1.76 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.682 2.254 . . . . 0.0 112.343 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.772 ' C ' HD11 ' A' ' 2' ' ' ILE . 7.2 mm-40 -37.99 -52.93 1.38 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.555 ' N ' HD11 ' A' ' 2' ' ' ILE . 4.9 m120 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.726 0.298 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.72 HD12 ' HD3' ' A' ' 28' ' ' LYS . 5.9 mm -70.56 90.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.146 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.78 ' OD1' ' HB2' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -90.51 -174.22 4.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.899 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.548 ' HB2' HD13 ' A' ' 87' ' ' LEU . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.006 HG22 ' O ' ' A' ' 25' ' ' PHE . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.799 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.766 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.766 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.672 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 1.006 ' O ' HG22 ' A' ' 5' ' ' VAL . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.72 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.004 ' CG2' HG21 ' A' ' 5' ' ' VAL . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.484 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.672 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.403 ' O ' HG12 ' A' ' 40' ' ' VAL . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.702 ' CD1' HD21 ' A' ' 59' ' ' LEU . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.43 ' CE2' ' NE2' ' A' ' 46' ' ' GLN . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.43 ' NE2' ' CE2' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.497 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.858 HG23 HG12 ' A' ' 70' ' ' VAL . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.552 ' CB ' HD12 ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 43' ' ' LEU . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.858 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.536 ' HE2' HD21 ' B' ' 122' ' ' LEU . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.7 ' CD2' HD23 ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.62 ' O ' HD21 ' A' ' 11' ' ' LEU . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.865 ' HG ' HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.799 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.6 t -37.17 142.15 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.5 p -148.71 123.1 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.153 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 4' ' ' GLN . 3.6 mp -90.73 92.73 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.874 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.78 ' HB2' ' OD1' ' A' ' 3' ' ' ASN . . . -137.31 -157.87 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.13 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.133 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -169.26 54.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.88 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -99.62 127.63 45.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.667 HG23 ' N ' ' B' ' 119' ' ' PHE . 3.7 t -173.45 -156.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.179 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.667 ' N ' HG23 ' B' ' 118' ' ' THR . 2.9 t80 -49.74 -32.4 13.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' SER . . . . . 0.613 ' H ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.536 HD21 ' HE2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.792 HD11 ' O ' ' A' ' 70' ' ' VAL . 2.6 mp -46.67 164.44 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 64.7 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.55 ' O ' ' ND2' ' B' ' 129' ' ' ASN . 4.1 pt-20 -120.4 99.89 6.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.55 ' ND2' ' O ' ' B' ' 128' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.715 ' H3 ' ' CB ' ' B' ' 129' ' ' ASN . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.76 0.314 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.54 HD12 ' HD3' ' A' ' 28' ' ' LYS . 8.7 mm -37.72 154.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.173 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.554 ' H ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -167.73 -179.77 4.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.891 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.054 HG11 HD22 ' A' ' 84' ' ' LEU . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.534 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.516 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.685 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.434 ' CD2' ' HA ' ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.898 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.434 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.807 ' O ' HG22 ' A' ' 5' ' ' VAL . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.772 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.554 HG23 ' H ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.54 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.059 HG11 HD21 ' A' ' 84' ' ' LEU . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.794 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.898 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.527 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.74 HG23 HG12 ' A' ' 70' ' ' VAL . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.514 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.496 ' HB2' HD21 ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.749 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.749 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.481 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.433 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.735 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.74 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HZ1' ' CE1' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.788 HD22 HD21 ' B' ' 126' ' ' LEU . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.486 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.798 HD22 ' CD1' ' A' ' 84' ' ' LEU . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.059 HD21 HG11 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t -37.51 142.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.628 ' C ' HD23 ' A' ' 87' ' ' LEU . 17.3 p -139.52 152.74 47.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.156 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD23 ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER -119.34 -38.39 3.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -94.71 132.79 39.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.14 -179.904 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.14 -169.94 2.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.88 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -163.02 -40.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.469 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER -74.27 -153.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.189 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.602 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -40.92 -42.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.881 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.602 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.794 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.2 tp -42.29 102.45 0.27 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' B' ' 126' ' ' LEU . 53.4 Cg_endo -69.82 85.14 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.667 2.244 . . . . 0.0 112.324 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.462 ' O ' ' CB ' ' B' ' 129' ' ' ASN . 1.9 mp0 -46.67 -24.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.715 ' CB ' ' H3 ' ' A' ' 1' ' ' GLN . 1.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.821 0.343 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.773 HD12 ' HD3' ' A' ' 28' ' ' LYS . 19.0 mm -131.94 65.47 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.144 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.534 ' OD1' ' HB2' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -108.76 -175.78 2.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.713 ' O ' HG21 ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD3' HG13 ' A' ' 5' ' ' VAL . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.587 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.768 ' CD2' HD22 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.714 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.976 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.565 HG21 ' HA ' ' A' ' 2' ' ' ILE . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.773 ' HD3' HD12 ' A' ' 2' ' ' ILE . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 26' ' ' THR . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.631 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.714 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.569 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.57 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HG2' ' OD1' ' A' ' 45' ' ' ASP . 1.9 mm100 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.488 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.451 ' O ' HG11 ' A' ' 70' ' ' VAL . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.707 ' HB3' HD13 ' B' ' 122' ' ' LEU . 13.4 p80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.983 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.625 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.801 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.801 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.983 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.939 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.484 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.593 HD21 ' CE ' ' A' ' 31' ' ' MET . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.492 ' HH ' ' C ' ' B' ' 128' ' ' GLU . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.019 HD22 ' CD2' ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.668 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD2' HD22 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.752 ' O ' HG22 ' A' ' 5' ' ' VAL . 0.3 OUTLIER -117.4 85.08 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.3 p -100.31 153.04 19.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.138 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.629 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 3.1 mp -112.66 95.39 5.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.629 ' HB2' ' O ' ' A' ' 87' ' ' LEU . . . 166.23 72.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.809 0.337 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -178.01 82.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -129.79 179.54 5.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 2.2 m -84.22 148.58 26.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.145 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -43.45 -57.76 2.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.894 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.812 HD12 ' CG2' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.562 ' O ' HD12 ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.536 ' O ' HD23 ' B' ' 125' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.631 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -37.01 142.36 0.37 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.476 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 53.7 Cg_endo -69.71 -14.45 36.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 0.0 112.366 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.492 ' C ' ' HH ' ' A' ' 77' ' ' TYR . 0.3 OUTLIER 75.7 -55.38 0.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.548 HD12 ' HD3' ' A' ' 28' ' ' LYS . 5.2 mm -97.47 99.14 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.0 t30 -88.04 154.49 20.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.893 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.77 HG21 HG21 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.784 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HD3' HG13 ' A' ' 5' ' ' VAL . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.887 HD11 ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.716 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.893 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.438 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.993 ' CG1' HD21 ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.944 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.444 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.893 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 119' ' ' PHE . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.493 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.705 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.705 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.508 ' OE1' ' CD2' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' OE1' ' O ' ' B' ' 117' ' ' GLU . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.941 ' HB3' HD13 ' B' ' 122' ' ' LEU . 9.9 p80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.936 HG23 HG12 ' A' ' 70' ' ' VAL . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.767 ' HA ' HD21 ' A' ' 59' ' ' LEU . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.829 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.829 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.637 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.936 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.798 ' CD ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.482 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.494 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HG ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.887 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.993 HD21 ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.784 HG11 ' HB3' ' A' ' 6' ' ' ARG . 2.3 t -42.84 135.03 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 84' ' ' LEU . 17.6 p -132.95 130.08 39.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.167 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.664 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -95.76 118.91 33.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.97 113.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.116 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.806 0.336 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.64 153.59 47.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 49' ' ' GLN . 1.3 mt-10 -133.63 138.55 45.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 1.3 m -137.22 146.04 44.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -44.06 -59.01 2.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.414 ' CB ' ' O ' ' B' ' 118' ' ' THR . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER -37.42 136.94 0.67 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.482 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.0 Cg_endo -69.7 -0.2 6.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.706 2.271 . . . . 0.0 112.323 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.481 ' CG ' ' HG2' ' A' ' 31' ' ' MET . 0.0 OUTLIER -32.15 -39.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.891 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.434 ' N ' ' O ' ' B' ' 127' ' ' PRO . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.475 ' C ' HD13 ' A' ' 2' ' ' ILE . 5.0 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.692 HG22 HG21 ' A' ' 26' ' ' THR . 2.7 mm -94.71 72.05 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.117 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -82.39 136.31 34.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.746 ' NE2' HG23 ' A' ' 26' ' ' THR . 4.1 mm100 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.471 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.549 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.764 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.643 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.764 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.931 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.466 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.778 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.629 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 26' ' ' THR . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.751 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.544 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.931 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 58' ' ' LEU . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 1.009 HD13 HD21 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.762 ' HB3' HD13 ' B' ' 122' ' ' LEU . 22.4 p80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.954 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.475 ' O ' HD22 ' A' ' 43' ' ' LEU . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.557 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.651 ' H ' HD22 ' A' ' 58' ' ' LEU . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 1.009 HD21 HD13 ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.954 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.703 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.823 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.751 HD21 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 76' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.43 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.3 t -48.22 151.88 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.494 ' C ' HD23 ' A' ' 87' ' ' LEU . 20.0 p -141.29 121.89 14.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.183 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.719 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -96.75 -36.04 10.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.07 112.24 25.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.098 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.1 -166.36 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.5 OUTLIER -104.29 -156.62 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.456 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.61 -152.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.13 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.539 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -38.05 -42.81 0.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.823 HD22 ' CE ' ' A' ' 71' ' ' LYS . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.544 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp -57.53 127.42 77.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.471 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 54.0 Cg_endo -69.78 65.1 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 0.0 112.357 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.473 ' CB ' ' HG3' ' A' ' 28' ' ' LYS . 9.8 mt-10 -40.08 -68.88 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.432 ' C ' ' CD1' ' A' ' 2' ' ' ILE . 4.5 m-80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.893 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.602 ' O ' HD13 ' A' ' 2' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.718 0.294 . . . . 0.0 110.902 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.602 HD13 ' O ' ' A' ' 1' ' ' GLN . 21.4 mm -137.17 54.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.417 ' O ' HG12 ' A' ' 27' ' ' VAL . 5.0 t-20 -90.41 131.86 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.604 ' O ' HG22 ' A' ' 86' ' ' THR . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.587 HG12 HG22 ' A' ' 86' ' ' THR . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.508 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.481 ' HA ' HD23 ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.519 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.798 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.73 ' CD2' HD22 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 1.044 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.798 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.449 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 27' ' ' VAL . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.531 ' HE2' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 84' ' ' LEU . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.944 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.562 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 30' ' ' VAL . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 1.044 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.606 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.769 ' O ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.594 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 2.1 mm100 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.685 ' HB3' HD13 ' B' ' 122' ' ' LEU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.453 ' HE1' ' O ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 43' ' ' LEU . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.456 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.535 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.794 HD11 ' HB2' ' A' ' 83' ' ' ASN . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.681 HD21 ' HB2' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.532 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.681 ' HB2' HD21 ' A' ' 63' ' ' LEU . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.821 HD22 HD21 ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.41 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.523 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.026 HD23 ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 1.026 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.768 ' O ' HG12 ' A' ' 85' ' ' VAL . 7.3 t -58.4 83.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 4' ' ' GLN . 51.8 p -102.55 147.97 26.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.11 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.666 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -110.96 151.72 27.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.913 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 82.93 144.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.176 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.867 0.365 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 27.9 mm100 -38.73 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 76.01 141.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.856 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.683 HG23 ' N ' ' B' ' 119' ' ' PHE . 5.2 t -174.65 -152.09 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.161 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.683 ' N ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -48.78 -30.22 5.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.94 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 120' ' ' SER . . . . . 0.514 ' H ' HG23 ' B' ' 118' ' ' THR . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.45 ' C ' HD23 ' B' ' 122' ' ' LEU . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.793 HD23 ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' HE1' ' A' ' 31' ' ' MET . 0.1 OUTLIER -66.14 164.53 28.75 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 62.55 1.75 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.637 2.224 . . . . 0.0 112.341 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.477 ' HA ' ' CG ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -65.61 -41.42 92.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.807 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.404 ' C ' ' O ' ' B' ' 128' ' ' GLU . 17.5 m120 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.853 HG22 HG21 ' A' ' 26' ' ' THR . 0.3 OUTLIER 54.52 106.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.13 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER -125.21 119.85 29.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.786 HG21 ' CD1' ' A' ' 84' ' ' LEU . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.662 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.496 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.652 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.637 ' O ' HD22 ' A' ' 15' ' ' LEU . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.669 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.706 ' NE2' HD11 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.819 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.853 HG21 HG22 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.462 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.608 ' HD3' HD12 ' A' ' 2' ' ' ILE . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.894 HG11 ' CG ' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.672 ' HE3' HD12 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.407 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.819 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.541 HD13 HG21 ' A' ' 52' ' ' VAL . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.586 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.708 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.404 ' HG2' ' C ' ' A' ' 41' ' ' LYS . 4.5 mm100 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.708 HD21 ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.586 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.608 ' HA ' HG22 ' A' ' 70' ' ' VAL . 35.1 p80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG12 ' A' ' 70' ' ' VAL . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.859 ' HA ' HD21 ' A' ' 59' ' ' LEU . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.455 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 58' ' ' LEU . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.875 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.875 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.48 HD22 ' HA ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.958 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.622 ' CE ' HD22 ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.474 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' HH ' ' C ' ' B' ' 128' ' ' GLU . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' ASN . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 76' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.528 ' O ' HD13 ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.894 ' CG ' HG11 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -68.0 151.78 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.3 p -143.79 116.69 8.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.134 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.661 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -106.71 143.03 35.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.661 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 82.47 143.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 68.9 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.849 0.357 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.57 -166.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.34 -160.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.423 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 43.33 -152.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.67 -42.33 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' B' ' 118' ' ' THR . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.622 HD22 ' CE ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.672 HD12 ' HE3' ' A' ' 31' ' ' MET . 0.3 OUTLIER -40.69 137.76 1.35 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.474 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.3 Cg_endo -69.74 -11.29 30.57 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.691 2.26 . . . . 0.0 112.38 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.421 ' O ' ' CG2' ' A' ' 27' ' ' VAL . 64.2 mt-10 63.94 -73.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' B' ' 127' ' ' PRO . 12.2 t30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.841 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 28' ' ' LYS . 4.9 mm 58.44 42.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.174 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.615 ' OD1' ' HB3' ' A' ' 88' ' ' ALA . 3.9 t-20 -87.43 133.79 33.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.688 ' OE1' HG23 ' A' ' 26' ' ' THR . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.896 HG12 HG22 ' A' ' 86' ' ' THR . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.464 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.724 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.724 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.795 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' HD11 ' A' ' 12' ' ' LEU . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.655 ' O ' HG22 ' A' ' 5' ' ' VAL . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.688 HG23 ' OE1' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.979 HG21 HD11 ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.526 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.417 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.795 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.543 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.686 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.686 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.7 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.614 ' HA ' HG22 ' A' ' 70' ' ' VAL . 4.3 p80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.573 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.768 HG23 ' CG1' ' A' ' 70' ' ' VAL . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.822 ' HA ' HD21 ' A' ' 59' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.834 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.834 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.436 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.683 HD21 ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.677 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.768 ' CG1' HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HZ1' ' CD2' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.635 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.683 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 84' ' ' LEU . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.979 HD11 HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.761 ' O ' HG12 ' A' ' 85' ' ' VAL . 3.3 t -57.86 87.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.896 HG22 HG12 ' A' ' 5' ' ' VAL . 26.9 p -98.36 156.56 16.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.12 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.56 HD12 ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -146.06 -59.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.615 ' HB3' ' OD1' ' A' ' 3' ' ' ASN . . . -37.86 95.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.051 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 87' ' ' LEU . 2.7 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.147 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -152.33 93.44 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.913 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -120.21 133.59 55.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.436 HG22 ' N ' ' B' ' 119' ' ' PHE . 97.0 m -66.3 154.35 40.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -43.02 -55.54 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' B' ' 121' ' ' ASP . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.635 HD11 ' HB3' ' A' ' 73' ' ' PRO . 6.3 tp -46.67 104.71 0.42 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.482 ' HD2' HD12 ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.68 155.61 65.75 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 0.0 112.343 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.495 ' OE1' ' CD1' ' A' ' 2' ' ' ILE . 0.5 OUTLIER -98.32 -30.78 12.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.994 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.806 0.336 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.689 HG21 ' NZ ' ' A' ' 28' ' ' LYS . 9.0 mm -114.79 117.87 56.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 1.09 ' ND2' ' HB3' ' A' ' 88' ' ' ALA . 2.3 m-20 -109.59 178.2 4.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' C ' HG13 ' A' ' 5' ' ' VAL . 5.7 mm100 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.033 HG22 ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.636 ' H ' HG12 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.71 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.732 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.71 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.732 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.928 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 1.033 ' O ' HG22 ' A' ' 5' ' ' VAL . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.599 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.689 ' NZ ' HG21 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.025 HG11 HD11 ' A' ' 84' ' ' LEU . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.953 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.765 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.928 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.514 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.604 ' HB3' HD23 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.636 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.636 HD22 ' C ' ' A' ' 42' ' ' GLN . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.895 ' HB3' HD23 ' B' ' 122' ' ' LEU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.453 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.609 HG23 ' CG1' ' A' ' 70' ' ' VAL . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.77 HD21 ' CG ' ' A' ' 83' ' ' ASN . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.69 ' O ' HD13 ' B' ' 126' ' ' LEU . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.527 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.712 HD22 HD21 ' B' ' 126' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.604 ' SD ' HD12 ' A' ' 63' ' ' LEU . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.553 ' HG ' HD23 ' A' ' 84' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.77 ' CG ' HD21 ' A' ' 62' ' ' LEU . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.025 HD11 HG11 ' A' ' 30' ' ' VAL . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -85.13 13.65 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 85' ' ' VAL . 0.8 OUTLIER -34.56 101.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 0.3 OUTLIER -107.0 105.92 16.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.91 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 1.09 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . . . 161.96 71.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.086 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.142 -179.887 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.11 152.82 24.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.92 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -143.39 129.64 19.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.888 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.3 m -128.88 143.01 50.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.473 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -47.04 -59.07 3.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.421 ' HB3' HD13 ' B' ' 122' ' ' LEU . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.895 HD23 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.953 HD23 ' CE ' ' A' ' 31' ' ' MET . 6.4 tp -46.12 104.57 0.41 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.686 2.258 . . . . 0.0 112.337 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -7.63 58.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.929 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 2' ' ' ILE . 13.4 mm-40 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.817 0.341 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 1' ' ' GLN . 1.3 mm -130.35 168.15 23.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.645 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.4 OUTLIER 80.02 -166.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.911 HG21 HG21 ' A' ' 30' ' ' VAL . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.435 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 HG13 ' A' ' 30' ' ' VAL . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.782 ' O ' HG22 ' A' ' 5' ' ' VAL . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.768 HG11 ' HA ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.083 HG11 HD21 ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.748 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.742 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.672 ' OH ' HD23 ' A' ' 58' ' ' LEU . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 HG21 ' A' ' 52' ' ' VAL . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.488 ' HE2' ' O ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.625 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.625 HD12 ' C ' ' A' ' 42' ' ' GLN . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.412 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.733 ' HB3' HD13 ' B' ' 122' ' ' LEU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.521 HG21 HD13 ' A' ' 38' ' ' ILE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.624 ' CG ' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.672 HD23 ' OH ' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.531 HD21 HD22 ' A' ' 43' ' ' LEU . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.494 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.467 ' O ' HD12 ' A' ' 62' ' ' LEU . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.77 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.848 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.488 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.748 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.424 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.77 ' HG3' HD22 ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.712 HD22 HD23 ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.519 ' CB ' ' O ' ' A' ' 79' ' ' MET . 17.3 t-20 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.083 HD21 HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 5' ' ' VAL . 1.9 t -50.57 141.58 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.7 p -141.85 118.77 11.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.761 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -100.87 -170.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 53.67 29.7 9.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.117 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.132 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.8 OUTLIER -99.36 20.09 14.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.498 ' CG ' ' N ' ' B' ' 118' ' ' THR . 1.0 OUTLIER 83.25 -173.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.498 ' N ' ' CG ' ' B' ' 117' ' ' GLU . 0.2 OUTLIER 46.4 -151.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.577 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.96 -41.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.848 HD22 ' CE ' ' A' ' 71' ' ' LYS . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.674 ' O ' HD23 ' B' ' 125' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp -37.52 121.73 0.93 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.488 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.78 64.77 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.654 2.236 . . . . 0.0 112.318 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.23 -33.67 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.883 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.752 0.31 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.665 ' HA ' HG21 ' A' ' 27' ' ' VAL . 4.8 mm 64.38 90.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.095 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER -105.25 173.63 6.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.522 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.712 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' CD2' HD22 ' A' ' 12' ' ' LEU . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.831 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.563 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.836 ' O ' HG22 ' A' ' 5' ' ' VAL . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.665 HG21 ' HA ' ' A' ' 2' ' ' ILE . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.7 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.415 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.831 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.611 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.474 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.459 ' OE1' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.611 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.684 ' HA ' HG22 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.574 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.495 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.74 HD13 ' OE2' ' A' ' 61' ' ' GLU . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.74 ' OE2' HD13 ' A' ' 58' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.574 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.684 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.544 ' NZ ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.7 HD21 ' CE ' ' A' ' 31' ' ' MET . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.437 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.902 HD22 HD13 ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.737 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.902 HD13 HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.695 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.9 t -49.46 130.46 7.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.8 p -124.4 124.56 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 0.5 OUTLIER -114.73 71.72 0.77 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.973 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 87' ' ' LEU . . . 176.48 177.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.085 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.873 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.841 0.353 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' GLN . . . . . 0.439 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER -122.16 -65.04 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.871 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 164.67 157.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.439 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.83 -152.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.591 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.72 -42.2 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.908 -180.0 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 50' ' ' HIS . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.681 HD11 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -82.64 136.74 44.91 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.443 ' O ' HD12 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.77 -165.57 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.361 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.53 -39.94 1.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.401 ' HB3' ' CD1' ' A' ' 2' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.849 ' O ' HG11 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.749 ' O ' HG22 ' A' ' 2' ' ' ILE . 35.2 mm -142.05 37.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 27' ' ' VAL . 79.6 m-20 -123.67 -174.77 3.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.019 HG11 ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.523 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.737 ' O ' HD22 ' A' ' 15' ' ' LEU . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.523 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.555 ' CD1' HD13 ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.737 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.97 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.705 ' O ' HG22 ' A' ' 5' ' ' VAL . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.849 HG11 ' O ' ' A' ' 1' ' ' GLN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.58 HG21 HG21 ' A' ' 5' ' ' VAL . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.736 ' HE2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.97 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.514 HD13 HG21 ' A' ' 52' ' ' VAL . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.662 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.662 HD12 ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB3' HD11 ' B' ' 122' ' ' LEU . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.642 ' HA ' HG22 ' A' ' 70' ' ' VAL . 22.3 p80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.71 HG23 HG12 ' A' ' 70' ' ' VAL . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.597 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 14' ' ' ILE . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.62 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.438 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.582 HD12 ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.62 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.62 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.902 HG21 HD12 ' B' ' 122' ' ' LEU . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.494 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.62 ' O ' HD21 ' A' ' 63' ' ' LEU . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.736 HD21 ' HE2' ' A' ' 31' ' ' MET . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.507 ' SD ' HD12 ' A' ' 63' ' ' LEU . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.875 ' HG ' HD23 ' A' ' 84' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HD3' HD12 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD1' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.73 ' O ' HG12 ' A' ' 5' ' ' VAL . 10.8 t -83.31 149.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.0 p -128.55 120.51 26.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.154 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.9 38.94 2.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -142.09 169.47 17.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.12 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.147 -179.9 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' GLN . . . . . 0.485 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER 69.71 122.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.918 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.485 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 1.0 OUTLIER 160.84 -85.9 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.573 HG22 ' N ' ' B' ' 119' ' ' PHE . 26.5 m -76.77 164.5 25.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.573 ' N ' HG22 ' B' ' 118' ' ' THR . 0.1 OUTLIER -44.46 -51.53 8.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.902 HD12 HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.642 ' O ' HD23 ' B' ' 126' ' ' LEU . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.642 HD23 ' O ' ' B' ' 123' ' ' TRP . 0.5 OUTLIER -34.85 97.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.7 Cg_endo -69.73 -2.42 10.13 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.73 2.287 . . . . 0.0 112.324 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.403 ' O ' ' OH ' ' A' ' 77' ' ' TYR . 5.0 mm-40 63.27 -75.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.896 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' B' ' 127' ' ' PRO . 1.6 t-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.499 ' O ' HG13 ' A' ' 2' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.768 0.318 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.789 HG21 ' CD ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER 38.26 -162.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.674 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER 170.7 -174.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.869 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.627 ' OE1' HG23 ' A' ' 26' ' ' THR . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.992 HG22 ' O ' ' A' ' 25' ' ' PHE . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.473 ' CB ' HG11 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.533 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.509 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.769 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.509 ' NE2' HD11 ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.994 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.769 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.992 ' O ' HG22 ' A' ' 5' ' ' VAL . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 1.033 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.674 HG23 ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.789 ' CD ' HG21 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.058 HG11 ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.82 ' CE ' HD13 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.518 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.994 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.459 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.4 mm100 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 1.155 ' CD2' HD21 ' B' ' 122' ' ' LEU . 34.5 m-70 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.589 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.74 ' HA ' HD21 ' A' ' 59' ' ' LEU . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.412 ' H ' ' CD2' ' A' ' 58' ' ' LEU . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.744 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.526 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.409 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.589 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.492 ' OH ' ' CB ' ' B' ' 128' ' ' GLU . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.897 HD22 HD12 ' A' ' 84' ' ' LEU . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.44 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.526 ' OD1' HD12 ' A' ' 62' ' ' LEU . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.058 ' CD2' HG11 ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.1 t -37.37 139.05 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 84' ' ' LEU . 14.1 p -138.68 138.54 37.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.594 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 3.1 mp -121.42 -54.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 76.93 105.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.106 -179.898 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.811 0.338 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.14 114.9 17.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.42 166.44 24.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.888 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.671 HG23 ' N ' ' B' ' 119' ' ' PHE . 4.9 t -173.24 -153.07 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.671 ' N ' HG23 ' B' ' 118' ' ' THR . 4.2 t80 -41.87 -27.76 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 1.155 HD21 ' CD2' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.848 ' CZ3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.848 HD11 ' CZ3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER -35.35 113.51 0.49 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' B' ' 128' ' ' GLU . 53.9 Cg_endo -69.76 64.67 1.81 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.711 2.274 . . . . 0.0 112.328 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.492 ' CB ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -37.8 -33.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.842 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.789 0.328 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.596 ' N ' HD13 ' A' ' 2' ' ' ILE . 2.6 mm 65.27 43.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.147 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -87.38 132.6 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 30' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.624 HD23 ' N ' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.631 HD11 ' O ' ' A' ' 83' ' ' ASN . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.674 ' N ' HD13 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.463 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' HB2' ' A' ' 37' ' ' TYR . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.793 ' O ' HG22 ' A' ' 5' ' ' VAL . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.83 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.753 HG11 ' C ' ' B' ' 129' ' ' ASN . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.512 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 5' ' ' VAL . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.632 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.429 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.439 HG21 HG13 ' A' ' 52' ' ' VAL . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.602 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.602 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.5 mm100 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.52 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.43 ' O ' HG11 ' A' ' 70' ' ' VAL . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CD2' ' C ' ' A' ' 50' ' ' HIS . 1.4 p-80 -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.504 ' HE2' ' C ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 70' ' ' VAL . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.881 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.881 HD21 ' HA ' ' A' ' 54' ' ' CYS . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.732 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.523 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.603 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.815 ' CG2' HD23 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.793 ' HD3' HD11 ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.747 ' CD2' HD23 ' A' ' 84' ' ' LEU . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.631 ' O ' HD11 ' A' ' 11' ' ' LEU . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.809 HD21 ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.61 ' O ' HG12 ' A' ' 5' ' ' VAL . 3.6 t -37.66 137.41 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 84' ' ' LEU . 16.6 p -136.17 120.73 18.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.162 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.3 mp -109.73 133.21 53.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 56.06 103.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.097 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 115' ' ' SER . . . . . 0.435 ' N ' ' OE2' ' B' ' 117' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.837 0.351 . . . . 0.0 110.93 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -106.21 123.64 48.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.93 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.668 ' HG3' HD13 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -169.27 128.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.859 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 90.3 m -51.52 150.44 3.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.144 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -45.38 -56.95 4.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.815 HD23 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.737 HD11 ' O ' ' A' ' 70' ' ' VAL . 1.6 mp -58.82 109.78 2.13 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.545 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.8 Cg_endo -69.75 62.09 1.75 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.655 2.237 . . . . 0.0 112.373 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' B' ' 127' ' ' PRO . 0.5 OUTLIER 34.37 -90.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.753 ' C ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.825 HG22 HG21 ' A' ' 26' ' ' THR . 0.4 OUTLIER 55.05 107.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.137 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.602 ' H ' HG12 ' A' ' 27' ' ' VAL . 0.7 OUTLIER -121.2 122.46 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.922 HG22 ' O ' ' A' ' 25' ' ' PHE . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.708 ' O ' HG11 ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.694 HD22 HG23 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.804 HD11 ' NE2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.804 ' NE2' HD11 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.425 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.922 ' O ' HG22 ' A' ' 5' ' ' VAL . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.825 HG21 HG22 ' A' ' 2' ' ' ILE . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.602 HG12 ' H ' ' A' ' 3' ' ' ASN . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.791 ' NZ ' HG23 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.528 ' N ' ' HD3' ' A' ' 28' ' ' LYS . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.893 HG11 ' CD1' ' A' ' 84' ' ' LEU . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.779 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 59' ' ' LEU . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.434 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 41' ' ' LYS . 0.8 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.83 HD13 ' CD2' ' A' ' 59' ' ' LEU . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG11 ' A' ' 70' ' ' VAL . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.731 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.601 ' HA ' HD21 ' A' ' 59' ' ' LEU . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.458 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.851 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.455 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.527 HD12 ' HB2' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.7 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.851 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.748 ' O ' HD13 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.623 HD22 HD21 ' B' ' 126' ' ' LEU . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' B' ' 129' ' ' ASN . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.7 ' HG3' HD22 ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.527 ' HB2' HD12 ' A' ' 62' ' ' LEU . 5.0 t-20 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.893 ' CD1' HG11 ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.708 HG11 ' O ' ' A' ' 6' ' ' ARG . 73.3 t -47.25 91.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 84' ' ' LEU . 71.6 p -114.89 139.45 49.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 87' ' ' LEU . 0.5 OUTLIER -109.8 35.99 3.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.895 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 -171.1 3.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.097 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.155 -179.866 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.805 0.336 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 71.52 124.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.927 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.61 -156.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.956 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.576 HG22 ' N ' ' B' ' 119' ' ' PHE . 24.9 m -42.4 165.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.576 ' N ' HG22 ' B' ' 118' ' ' THR . 0.3 OUTLIER -48.27 -30.15 4.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.915 179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.63 ' CZ3' HD22 ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.748 HD13 ' O ' ' A' ' 70' ' ' VAL . 11.1 tp -50.58 112.3 2.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.665 ' HD2' HD12 ' B' ' 126' ' ' LEU . 53.8 Cg_endo -69.77 157.69 59.5 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.77 -36.39 10.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 77' ' ' TYR . 2.7 m120 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.85 ' HA ' HG11 ' A' ' 27' ' ' VAL . 1.5 pp -124.57 102.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.17 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -97.54 168.23 10.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.519 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 1.026 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.549 ' CB ' HG11 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.537 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.769 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.769 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.973 ' O ' HG22 ' A' ' 5' ' ' VAL . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.85 HG11 ' HA ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.425 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.026 ' CG2' HG21 ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.775 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.851 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.952 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 43' ' ' LEU . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.597 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.665 ' CZ ' ' NE2' ' A' ' 46' ' ' GLN . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.665 ' NE2' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.583 ' O ' HG11 ' A' ' 70' ' ' VAL . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.447 ' C ' HG13 ' A' ' 70' ' ' VAL . 1.6 p80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.493 ' HE1' ' O ' ' A' ' 68' ' ' PHE . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.849 HG11 ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' SER . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.686 ' CB ' HD11 ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.5 ' OD1' HD21 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.686 HD11 ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.645 HD12 ' ND2' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.484 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.849 ' CD1' HG11 ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.706 ' O ' HD11 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.847 ' HE2' HD22 ' B' ' 122' ' ' LEU . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.775 HD21 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.94 ' CD2' HD23 ' A' ' 84' ' ' LEU . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.645 ' ND2' HD12 ' A' ' 62' ' ' LEU . 12.7 t-20 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.94 HD23 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.549 HG11 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER -41.58 145.49 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.524 ' C ' HD23 ' A' ' 87' ' ' LEU . 17.8 p -140.08 135.45 32.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.524 HD23 ' C ' ' A' ' 86' ' ' THR . 0.1 OUTLIER -115.25 155.81 26.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.938 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.04 88.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.117 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 -179.841 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.794 0.33 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -163.39 146.21 10.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.6 151.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.923 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.736 HG23 ' N ' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -172.54 -173.43 1.03 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.736 ' N ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -45.01 -48.3 11.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 120' ' ' SER . . . . . 0.532 ' H ' HG23 ' B' ' 118' ' ' THR . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.847 HD22 ' HE2' ' A' ' 71' ' ' LYS . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.58 ' HD2' HD23 ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.722 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.89 107.62 0.86 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.422 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.6 Cg_endo -69.77 -6.78 19.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.229 . . . . 0.0 112.349 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.459 ' O ' HG21 ' A' ' 27' ' ' VAL . 0.2 OUTLIER 78.81 -3.24 2.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.905 -179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.788 0.327 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.656 HD12 ' HE2' ' A' ' 28' ' ' LYS . 5.6 mm 70.64 99.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -111.91 132.23 54.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.883 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.485 ' HB2' ' CD1' ' A' ' 87' ' ' LEU . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.576 HG11 HD11 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.505 ' N ' HG23 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.668 ' HG3' HD12 ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.513 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.742 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.746 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.742 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.746 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.756 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.419 ' H ' HG23 ' A' ' 27' ' ' VAL . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.656 ' HE2' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.854 HG11 HD21 ' A' ' 84' ' ' LEU . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.687 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.892 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.932 HD13 HG21 ' A' ' 52' ' ' VAL . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' CE ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.462 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.523 ' HB3' HD23 ' A' ' 43' ' ' LEU . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.523 HD23 ' HB3' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.704 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.932 HG21 HD13 ' A' ' 38' ' ' ILE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' ND2' ' A' ' 83' ' ' ASN . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.708 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.916 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.546 ' HE2' ' CG ' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.617 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.795 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.617 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 HD23 ' A' ' 84' ' ' LEU . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.912 HD23 HD22 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -73.91 -5.14 6.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 85' ' ' VAL . 5.6 p 36.14 -155.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.131 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 4' ' ' GLN . 2.2 mt -104.83 -57.24 2.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.905 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -101.55 143.02 32.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.131 -179.888 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.08 77.17 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.933 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 117' ' ' GLU . . . . . 0.724 ' C ' HG22 ' B' ' 118' ' ' THR . 21.2 tt0 73.29 -65.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.726 HG23 ' H ' ' B' ' 119' ' ' PHE . 0.0 OUTLIER 159.13 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.141 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.726 ' H ' HG23 ' B' ' 118' ' ' THR . 0.3 OUTLIER -50.31 -47.12 55.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.432 ' O ' HD13 ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.451 ' O ' ' CD ' ' B' ' 127' ' ' PRO . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.812 HD11 ' O ' ' A' ' 70' ' ' VAL . 5.3 mp -106.12 73.45 0.29 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.7 Cg_endo -69.77 -24.78 29.22 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 0.0 112.338 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' B' ' 127' ' ' PRO . 0.0 OUTLIER 158.1 -31.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.502 ' CA ' ' OH ' ' A' ' 77' ' ' TYR . 3.5 m120 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ILE . 10.8 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.411 ' HA ' HG21 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -50.9 -175.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.48 ' H ' ' CG2' ' A' ' 27' ' ' VAL . 4.6 t-20 -171.12 130.46 0.76 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.612 HG21 HG21 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.45 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.459 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 83' ' ' ASN . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.445 HD11 HD21 ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.699 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.971 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.793 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.679 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.481 HG21 ' O ' ' B' ' 129' ' ' ASN . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 26' ' ' THR . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.724 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.408 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.793 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.971 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.534 HD13 HG11 ' A' ' 52' ' ' VAL . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.609 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.549 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.604 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.604 HD22 ' C ' ' A' ' 42' ' ' GLN . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.609 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.474 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 2.1 mm100 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.494 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.551 ' N ' HD23 ' B' ' 122' ' ' LEU . 1.2 p80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.955 HG23 HG12 ' A' ' 70' ' ' VAL . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.464 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 58' ' ' LEU . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD22 ' HD3' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.638 ' HD3' HD22 ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.955 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.407 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.662 HD22 HD21 ' B' ' 126' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 76' ' ' LEU . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.47 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.627 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.025 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.405 ' CG1' ' N ' ' A' ' 86' ' ' THR . 0.9 OUTLIER -89.3 152.89 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.405 ' N ' ' CG1' ' A' ' 85' ' ' VAL . 0.8 OUTLIER -151.56 116.72 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.146 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.725 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -102.25 85.18 2.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -163.01 -177.7 5.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.063 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.107 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.57 121.28 21.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.911 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -167.15 -49.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' THR . . . . . 0.762 HG23 ' N ' ' B' ' 119' ' ' PHE . 3.1 t -179.54 -151.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 119' ' ' PHE . . . . . 0.762 ' N ' HG23 ' B' ' 118' ' ' THR . 0.2 OUTLIER -37.89 -42.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 121' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 118' ' ' THR . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.724 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -37.76 136.45 0.74 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 127' ' ' PRO . . . . . 0.474 ' C ' ' CG ' ' B' ' 128' ' ' GLU . 54.3 Cg_endo -69.7 -22.45 32.34 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.663 2.242 . . . . 0.0 112.327 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 128' ' ' GLU . . . . . 0.474 ' CG ' ' C ' ' B' ' 127' ' ' PRO . 0.6 OUTLIER 64.12 -73.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.9 -179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 129' ' ' ASN . . . . . 0.481 ' O ' HG21 ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.911 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.799 0.333 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 6' ' ' ARG . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.476 ' N ' HG23 ' A' ' 5' ' ' VAL . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.751 ' HE2' HG21 ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.428 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.612 HD11 ' NE2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.766 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.612 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 1.027 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.766 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.481 ' HE3' ' CB ' ' A' ' 26' ' ' THR . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.123 HG11 HD11 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.702 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 1.027 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.43 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.557 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.448 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 4.8 mm-40 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.82 HG23 HG12 ' A' ' 70' ' ' VAL . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.825 ' HA ' HD21 ' A' ' 59' ' ' LEU . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.819 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.483 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.64 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.82 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.563 ' HE2' HD22 ' B' ' 122' ' ' LEU . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.74 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.123 HD11 HG11 ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 8' ' ' LYS . 9.0 t . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.563 HD22 ' HE2' ' A' ' 71' ' ' LYS . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.554 HD13 ' CG ' ' A' ' 71' ' ' LYS . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.74 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.662 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 19.0 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.545 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.731 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.715 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.731 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.715 ' CD2' HD22 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.748 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.762 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.419 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.895 ' O ' HG22 ' A' ' 5' ' ' VAL . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.703 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.865 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.762 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.748 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 52' ' ' VAL . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.48 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.488 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.63 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.974 HG23 HG12 ' A' ' 70' ' ' VAL . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.545 ' N ' HG12 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.553 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.488 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 58' ' ' LEU . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.748 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.623 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.974 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.623 ' SD ' HD12 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.722 ' CD2' HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.545 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.576 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.485 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.949 ' O ' HD12 ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.949 HD12 ' O ' ' B' ' 123' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.661 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.761 0.315 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.006 HG22 ' O ' ' A' ' 25' ' ' PHE . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.799 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.766 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.766 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.672 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 1.006 ' O ' HG22 ' A' ' 5' ' ' VAL . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.004 ' CG2' HG21 ' A' ' 5' ' ' VAL . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.484 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.672 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.403 ' O ' HG12 ' A' ' 40' ' ' VAL . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.484 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.702 ' CD1' HD21 ' A' ' 59' ' ' LEU . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.463 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.463 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 5.7 mm-40 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.497 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.858 HG23 HG12 ' A' ' 70' ' ' VAL . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.552 ' CB ' HD12 ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 43' ' ' LEU . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.858 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.536 ' HE2' HD21 ' B' ' 122' ' ' LEU . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.7 ' CD2' HD23 ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.62 ' O ' HD21 ' A' ' 11' ' ' LEU . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.865 ' HG ' HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.799 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.6 t . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.627 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 2.9 t80 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.536 HD21 ' HE2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.792 HD11 ' O ' ' A' ' 70' ' ' VAL . 2.6 mp . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.462 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.054 HG11 HD22 ' A' ' 84' ' ' LEU . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.534 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.516 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.685 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.49 ' CD2' HE21 ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.898 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.49 HE21 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.807 ' O ' HG22 ' A' ' 5' ' ' VAL . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.772 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.059 HG11 HD21 ' A' ' 84' ' ' LEU . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.794 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.898 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.527 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.533 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.783 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.6 OUTLIER -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.504 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.3 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.74 HG23 HG12 ' A' ' 70' ' ' VAL . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.514 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.496 ' HB2' HD21 ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.749 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.749 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.481 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.433 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.735 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.74 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HZ1' ' CE1' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.788 HD22 HD21 ' B' ' 126' ' ' LEU . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.486 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.798 HD22 ' CD1' ' A' ' 84' ' ' LEU . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.059 HD21 HG11 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.602 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.896 0.379 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.602 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.794 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.2 tp . . . . . 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.522 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.755 0.312 . . . . 0.0 110.948 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.493 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.713 ' O ' HG21 ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD3' HG13 ' A' ' 5' ' ' VAL . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.587 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.768 ' CD2' HD22 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.714 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.976 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 26' ' ' THR . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.631 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.714 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.569 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.57 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.499 ' NE2' ' N ' ' A' ' 42' ' ' GLN . 0.2 OUTLIER 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.778 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.545 ' NE2' ' CB ' ' A' ' 46' ' ' GLN . 5.0 mm-40 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.582 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.451 ' O ' HG11 ' A' ' 70' ' ' VAL . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.707 ' HB3' HD13 ' B' ' 122' ' ' LEU . 9.8 p-80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.592 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.983 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.625 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.801 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.801 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.983 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.939 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.484 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.593 HD21 ' CE ' ' A' ' 31' ' ' MET . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.019 HD22 ' CD2' ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.816 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD2' HD22 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.752 ' O ' HG22 ' A' ' 5' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.896 0.379 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.812 HD12 ' CG2' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.562 ' O ' HD12 ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.536 ' O ' HD23 ' B' ' 125' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.631 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 27' ' ' VAL . 6.3 t-20 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.803 0.335 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.454 ' H ' ' ND2' ' A' ' 3' ' ' ASN . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.77 HG21 HG21 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.784 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HD3' HG13 ' A' ' 5' ' ' VAL . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.887 HD11 ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.716 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.893 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.993 ' CG1' HD21 ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.944 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.444 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.893 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 119' ' ' PHE . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.493 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.685 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.555 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.555 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.439 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 8.4 mm-40 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.941 ' HB3' HD13 ' B' ' 122' ' ' LEU . 5.9 p-80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.936 HG23 HG12 ' A' ' 70' ' ' VAL . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.767 ' HA ' HD21 ' A' ' 59' ' ' LEU . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.829 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.829 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.637 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.936 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.798 ' CD ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.422 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.494 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HG ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.887 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.993 HD21 ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.784 HG11 ' HB3' ' A' ' 6' ' ' ARG . 2.3 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.862 0.363 . . . . 0.0 110.896 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.775 0.321 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.593 ' OE1' HG23 ' A' ' 26' ' ' THR . 13.1 mm-40 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.471 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.549 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.764 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.643 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.764 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.931 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.466 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.778 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 26' ' ' THR . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.751 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.544 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.931 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 58' ' ' LEU . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.421 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 1.009 HD13 HD21 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.8 mm-40 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.52 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.762 ' HB3' HD13 ' B' ' 122' ' ' LEU . 7.9 p-80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.954 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.475 ' O ' HD22 ' A' ' 43' ' ' LEU . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.557 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.651 ' H ' HD22 ' A' ' 58' ' ' LEU . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 1.009 HD21 HD13 ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.954 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.703 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.823 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.751 HD21 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 76' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.43 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.539 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.823 HD22 ' CE ' ' A' ' 71' ' ' LYS . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.544 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.545 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.813 0.339 . . . . 0.0 110.862 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.545 ' N ' HD22 ' A' ' 3' ' ' ASN . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 30' ' ' VAL . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.508 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.481 ' HA ' HD23 ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.519 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.798 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.73 ' CD2' HD22 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 1.044 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.798 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.449 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 27' ' ' VAL . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 84' ' ' LEU . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.944 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.562 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 30' ' ' VAL . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 1.044 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.606 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.769 ' O ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.463 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 6.0 mm-40 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.685 ' HB3' HD13 ' B' ' 122' ' ' LEU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.453 ' HE1' ' O ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 43' ' ' LEU . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.456 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.535 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.794 HD11 ' HB2' ' A' ' 83' ' ' ASN . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.681 HD21 ' HB2' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.532 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.681 ' HB2' HD21 ' A' ' 63' ' ' LEU . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.821 HD22 HD21 ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.41 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.523 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.026 HD23 ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 1.026 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.768 ' O ' HG12 ' A' ' 85' ' ' VAL . 7.3 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.892 0.377 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.45 ' C ' HD23 ' B' ' 122' ' ' LEU . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.793 HD23 ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' HE1' ' A' ' 31' ' ' MET . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.764 0.316 . . . . 0.0 110.881 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.786 HG21 ' CD1' ' A' ' 84' ' ' LEU . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.662 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.496 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.652 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.637 ' O ' HD22 ' A' ' 15' ' ' LEU . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.669 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.706 ' NE2' HD11 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.819 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.462 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.894 HG11 ' CG ' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.672 ' HE3' HD12 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.407 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.819 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.541 HD13 HG21 ' A' ' 52' ' ' VAL . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.586 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.708 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.479 ' NE2' ' O ' ' A' ' 39' ' ' MET . 17.6 mm-40 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.708 HD21 ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.586 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.64 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.3 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.608 ' HA ' HG22 ' A' ' 70' ' ' VAL . 29.2 p-80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG12 ' A' ' 70' ' ' VAL . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.859 ' HA ' HD21 ' A' ' 59' ' ' LEU . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.455 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 58' ' ' LEU . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.875 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.875 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.48 HD22 ' HA ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.958 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.622 ' CE ' HD22 ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' ASN . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 76' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.528 ' O ' HD13 ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.894 ' CG ' HG11 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.847 0.356 . . . . 0.0 110.87 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.622 HD22 ' CE ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.672 HD12 ' HE3' ' A' ' 31' ' ' MET . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.521 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.739 0.305 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.688 ' OE1' HG23 ' A' ' 26' ' ' THR . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.863 HG21 HG21 ' A' ' 30' ' ' VAL . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.464 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.724 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.724 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.795 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' HD11 ' A' ' 12' ' ' LEU . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.655 ' O ' HG22 ' A' ' 5' ' ' VAL . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.688 HG23 ' OE1' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.979 HG21 HD11 ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.526 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.417 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.795 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.543 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.698 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.539 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.614 ' HA ' HG22 ' A' ' 70' ' ' VAL . 3.5 p-80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.503 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.768 HG23 ' CG1' ' A' ' 70' ' ' VAL . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.557 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.822 ' HA ' HD21 ' A' ' 59' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.834 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.834 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.436 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.683 HD21 ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.677 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.768 ' CG1' HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.546 ' HZ2' ' CD2' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.635 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.683 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 84' ' ' LEU . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.979 HD11 HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.761 ' O ' HG12 ' A' ' 85' ' ' VAL . 3.3 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.856 0.36 . . . . 0.0 110.857 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' B' ' 121' ' ' ASP . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.635 HD11 ' HB3' ' A' ' 73' ' ' PRO . 6.3 tp . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.599 ' O ' HG22 ' A' ' 26' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.753 0.311 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' C ' HG13 ' A' ' 5' ' ' VAL . 21.4 mm-40 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.033 HG22 ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.636 ' H ' HG12 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.71 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.732 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.71 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.732 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.928 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 1.033 ' O ' HG22 ' A' ' 5' ' ' VAL . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.599 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.025 HG11 HD11 ' A' ' 84' ' ' LEU . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.953 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.765 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.928 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.514 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.604 ' HB3' HD23 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.636 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.636 HD22 ' C ' ' A' ' 42' ' ' GLN . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.66 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.895 ' HB3' HD23 ' B' ' 122' ' ' LEU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.453 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.609 HG23 ' CG1' ' A' ' 70' ' ' VAL . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.77 HD21 ' CG ' ' A' ' 83' ' ' ASN . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.69 ' O ' HD13 ' B' ' 126' ' ' LEU . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.527 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.712 HD22 HD21 ' B' ' 126' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.604 ' SD ' HD12 ' A' ' 63' ' ' LEU . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.553 ' HG ' HD23 ' A' ' 84' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.77 ' CG ' HD21 ' A' ' 62' ' ' LEU . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.025 HD11 HG11 ' A' ' 30' ' ' VAL . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.473 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.857 0.36 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.421 ' HB3' HD13 ' B' ' 122' ' ' LEU . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.895 HD23 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.953 HD23 ' CE ' ' A' ' 31' ' ' MET . 6.4 tp . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.645 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.771 0.319 . . . . 0.0 110.901 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.441 ' NE2' ' OD1' ' A' ' 3' ' ' ASN . 2.2 mp0 -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.911 HG21 HG21 ' A' ' 30' ' ' VAL . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.435 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 HG13 ' A' ' 30' ' ' VAL . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.782 ' O ' HG22 ' A' ' 5' ' ' VAL . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 3' ' ' ASN . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.083 HG11 HD21 ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.748 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.742 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.672 ' OH ' HD23 ' A' ' 58' ' ' LEU . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 HG21 ' A' ' 52' ' ' VAL . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.488 ' HE2' ' O ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.625 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.625 HD12 ' C ' ' A' ' 42' ' ' GLN . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.412 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.441 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.5 mm-40 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.733 ' HB3' HD13 ' B' ' 122' ' ' LEU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.521 HG21 HD13 ' A' ' 38' ' ' ILE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.624 ' CG ' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.672 HD23 ' OH ' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.531 HD21 HD22 ' A' ' 43' ' ' LEU . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.494 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.579 HD21 ' ND2' ' A' ' 83' ' ' ASN . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.77 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.848 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.424 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.748 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.424 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.77 ' HG3' HD22 ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.712 HD22 HD23 ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.579 ' ND2' HD21 ' A' ' 62' ' ' LEU . 45.9 t30 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.083 HD21 HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 5' ' ' VAL . 1.9 t . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.577 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.848 HD22 ' CE ' ' A' ' 71' ' ' LYS . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.674 ' O ' HD23 ' B' ' 125' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 0.0 110.882 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.522 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.712 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' CD2' HD22 ' A' ' 12' ' ' LEU . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.831 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.563 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.836 ' O ' HG22 ' A' ' 5' ' ' VAL . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.413 HG23 ' H ' ' A' ' 27' ' ' VAL . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.7 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.415 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.831 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.611 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.609 ' O ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.609 ' NE2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.611 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.5 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.3 mm-40 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.684 ' HA ' HG22 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.542 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.574 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.495 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.74 HD13 ' OE2' ' A' ' 61' ' ' GLU . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.74 ' OE2' HD13 ' A' ' 58' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.574 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.44 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.684 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.544 ' NZ ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.7 HD21 ' CE ' ' A' ' 31' ' ' MET . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.437 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.902 HD22 HD13 ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.869 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.902 HD13 HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.695 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.9 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.591 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.879 0.371 . . . . 0.0 110.908 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 50' ' ' HIS . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.681 HD11 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 27' ' ' VAL . 19.6 m120 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.779 0.323 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.019 HG11 ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.523 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.737 ' O ' HD22 ' A' ' 15' ' ' LEU . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.523 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.555 ' CD1' HD13 ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.737 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.97 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.705 ' O ' HG22 ' A' ' 5' ' ' VAL . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.411 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.58 HG21 HG21 ' A' ' 5' ' ' VAL . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.736 ' HE2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.97 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.514 HD13 HG21 ' A' ' 52' ' ' VAL . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.662 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.52 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.662 HD12 ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.582 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.4 mp0 -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB3' HD11 ' B' ' 122' ' ' LEU . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.642 ' HA ' HG22 ' A' ' 70' ' ' VAL . 26.1 p-80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.71 HG23 HG12 ' A' ' 70' ' ' VAL . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.597 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 14' ' ' ILE . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.62 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.438 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.582 HD12 ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.62 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.62 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.902 HG21 HD12 ' B' ' 122' ' ' LEU . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.494 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.62 ' O ' HD21 ' A' ' 63' ' ' LEU . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.736 HD21 ' HE2' ' A' ' 31' ' ' MET . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.507 ' SD ' HD12 ' A' ' 63' ' ' LEU . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.875 ' HG ' HD23 ' A' ' 84' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HD3' HD12 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD1' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.73 ' O ' HG12 ' A' ' 5' ' ' VAL . 10.8 t . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.473 ' O ' ' N ' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.839 0.352 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.902 HD12 HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.642 ' O ' HD23 ' B' ' 126' ' ' LEU . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.642 HD23 ' O ' ' B' ' 123' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.674 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.808 0.337 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.627 ' OE1' HG23 ' A' ' 26' ' ' THR . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.992 HG22 ' O ' ' A' ' 25' ' ' PHE . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.473 ' CB ' HG11 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.533 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.509 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.769 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.509 ' NE2' HD11 ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.994 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.769 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.992 ' O ' HG22 ' A' ' 5' ' ' VAL . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 1.033 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.674 HG23 ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.058 HG11 ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.82 ' CE ' HD13 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.518 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.994 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.571 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.6 mp0 -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.489 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.4 mm-40 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 1.127 ' CE1' HD21 ' B' ' 122' ' ' LEU . 14.0 m80 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.589 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.74 ' HA ' HD21 ' A' ' 59' ' ' LEU . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.412 ' H ' ' CD2' ' A' ' 58' ' ' LEU . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.744 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.526 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.409 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.589 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.627 ' HE2' ' CE1' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.897 HD22 HD12 ' A' ' 84' ' ' LEU . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.44 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.526 ' OD1' HD12 ' A' ' 62' ' ' LEU . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.058 ' CD2' HG11 ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CZ ' ' CE3' ' B' ' 123' ' ' TRP . 4.2 t80 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.89 0.376 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 1.127 HD21 ' CE1' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.848 ' CZ3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.848 HD11 ' CZ3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.52 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.52 ' N ' HD22 ' A' ' 3' ' ' ASN . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 30' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.624 HD23 ' N ' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.631 HD11 ' O ' ' A' ' 83' ' ' ASN . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.674 ' N ' HD13 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.463 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' HB2' ' A' ' 37' ' ' TYR . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.455 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.793 ' O ' HG22 ' A' ' 5' ' ' VAL . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.83 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.512 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 5' ' ' VAL . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.632 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.429 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.439 HG21 HG13 ' A' ' 52' ' ' VAL . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.602 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.462 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.602 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.559 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.9 mp0 -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.48 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.5 mm-40 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.52 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.43 ' O ' HG11 ' A' ' 70' ' ' VAL . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CD2' ' C ' ' A' ' 50' ' ' HIS . 1.4 p-80 -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.504 ' HE2' ' C ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 70' ' ' VAL . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.881 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.881 HD21 ' HA ' ' A' ' 54' ' ' CYS . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.732 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.523 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.603 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.815 ' CG2' HD23 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.793 ' HD3' HD11 ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.747 ' CD2' HD23 ' A' ' 84' ' ' LEU . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.631 ' O ' HD11 ' A' ' 11' ' ' LEU . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.809 HD21 ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.61 ' O ' HG12 ' A' ' 5' ' ' VAL . 3.6 t . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.832 0.349 . . . . 0.0 110.856 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.815 HD23 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.737 HD11 ' O ' ' A' ' 70' ' ' VAL . 1.6 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.816 0.341 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.922 HG22 ' O ' ' A' ' 25' ' ' PHE . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.708 ' O ' HG11 ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.694 HD22 HG23 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.804 HD11 ' NE2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.804 ' NE2' HD11 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.425 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.922 ' O ' HG22 ' A' ' 5' ' ' VAL . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.598 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 28' ' ' LYS . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.599 ' N ' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.528 ' N ' ' HD3' ' A' ' 28' ' ' LYS . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.893 HG11 ' CD1' ' A' ' 84' ' ' LEU . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.779 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 59' ' ' LEU . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.434 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.83 HD13 ' CD2' ' A' ' 59' ' ' LEU . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.789 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.7 OUTLIER -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.623 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.1 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG11 ' A' ' 70' ' ' VAL . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.731 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.601 ' HA ' HD21 ' A' ' 59' ' ' LEU . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.458 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.851 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.455 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.527 HD12 ' HB2' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.7 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.851 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.748 ' O ' HD13 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.623 HD22 HD21 ' B' ' 126' ' ' LEU . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.7 ' HG3' HD22 ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.822 HD23 HD22 ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.822 HD22 HD23 ' A' ' 80' ' ' LEU . 3.6 t30 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.893 ' CD1' HG11 ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.708 HG11 ' O ' ' A' ' 6' ' ' ARG . 73.3 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.573 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.886 0.374 . . . . 0.0 110.915 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.63 ' CZ3' HD22 ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.748 HD13 ' O ' ' A' ' 70' ' ' VAL . 11.1 tp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.776 0.322 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.519 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 1.026 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.549 ' CB ' HG11 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.537 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.769 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.769 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.973 ' O ' HG22 ' A' ' 5' ' ' VAL . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.43 ' H ' HG12 ' A' ' 27' ' ' VAL . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.425 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.026 ' CG2' HG21 ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.775 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.851 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.952 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 43' ' ' LEU . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.597 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.597 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.522 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.9 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.583 ' O ' HG11 ' A' ' 70' ' ' VAL . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.5 ' CD2' ' HG2' ' A' ' 51' ' ' MET . 2.1 p-80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.849 HG11 ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' SER . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.686 ' CB ' HD11 ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.5 ' OD1' HD21 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.686 HD11 ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.495 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.484 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.849 ' CD1' HG11 ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.706 ' O ' HD11 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.847 ' HE2' HD22 ' B' ' 122' ' ' LEU . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.775 HD21 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.94 ' CD2' HD23 ' A' ' 84' ' ' LEU . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 79' ' ' MET . 44.4 t30 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.94 HD23 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.549 HG11 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.714 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.892 0.377 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.847 HD22 ' HE2' ' A' ' 71' ' ' LYS . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.58 ' HD2' HD23 ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.722 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.524 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.82 0.343 . . . . 0.0 110.883 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.524 ' N ' HD22 ' A' ' 3' ' ' ASN . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.576 HG11 HD11 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.505 ' N ' HG23 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.668 ' HG3' HD12 ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.513 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.742 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.746 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.742 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.746 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.756 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.419 ' H ' HG23 ' A' ' 27' ' ' VAL . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.404 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.854 HG11 HD21 ' A' ' 84' ' ' LEU . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.687 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.892 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.932 HD13 HG21 ' A' ' 52' ' ' VAL . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' CE ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.462 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.523 ' HB3' HD23 ' A' ' 43' ' ' LEU . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.561 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.523 HD23 ' HB3' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.472 ' CB ' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 7.1 mm-40 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.704 ' HA ' HG22 ' A' ' 70' ' ' VAL . 2.0 p-80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.932 HG21 HD13 ' A' ' 38' ' ' ILE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' ND2' ' A' ' 83' ' ' ASN . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.708 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.916 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.617 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.795 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.617 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 HD23 ' A' ' 84' ' ' LEU . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.912 HD23 HD22 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.568 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.835 0.35 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.432 ' O ' HD13 ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.441 HD13 ' H ' ' B' ' 125' ' ' LEU . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.812 HD11 ' O ' ' A' ' 70' ' ' VAL . 5.3 mp . . . . . 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.5 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.5 ' N ' HD22 ' A' ' 3' ' ' ASN . 2.3 mp0 -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.612 HG21 HG21 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.45 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.459 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 83' ' ' ASN . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.445 HD11 HD21 ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.699 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.971 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.793 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.679 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 26' ' ' THR . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.724 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.408 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.793 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.971 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.534 HD13 HG11 ' A' ' 52' ' ' VAL . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.609 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.549 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.604 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.604 HD22 ' C ' ' A' ' 42' ' ' GLN . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.609 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.564 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.2 mp0 -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.6 mm-40 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.423 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.594 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 2.8 p-80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.955 HG23 HG12 ' A' ' 70' ' ' VAL . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.464 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 58' ' ' LEU . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.483 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD22 ' HD3' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.638 ' HD3' HD22 ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.955 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.407 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.662 HD22 HD21 ' B' ' 126' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 76' ' ' LEU . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.47 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.627 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.025 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' PHE . . . . . 0.582 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.724 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 2' ' ' ILE . 52.9 mm-40 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.794 0.33 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 27' ' ' VAL . 1.4 pp -37.6 111.45 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.148 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.46 174.56 5.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.878 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -70.98 155.61 40.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.959 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 6' ' ' ARG . 1.1 m -143.31 164.3 15.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.476 ' N ' HG23 ' A' ' 5' ' ' VAL . 6.3 mtp180 -135.29 110.26 10.6 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.612 0.72 . . . . 0.0 110.887 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.96 3.22 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.31 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.751 ' HE2' HG21 ' A' ' 85' ' ' VAL . 8.3 mttt -62.81 -154.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.866 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.545 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 7.3 mt -68.66 -65.11 1.43 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.605 0.717 . . . . 0.0 110.854 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.545 ' CD ' ' CB ' ' A' ' 9' ' ' LEU . 53.4 Cg_endo -69.77 -2.81 10.81 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.71 2.273 . . . . 0.0 112.312 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.428 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 0.8 OUTLIER -103.6 -27.82 12.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.612 HD11 ' NE2' ' A' ' 16' ' ' HIS . 5.9 tp -71.15 -49.36 44.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.903 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -30.29 59.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.906 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.5 mt -61.51 -54.49 34.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.766 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 4.5 mt -70.72 -35.75 72.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.612 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.1 m170 -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.855 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.88 -13.39 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.099 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 1.027 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -99.51 4.69 46.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.108 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.7 15.54 24.37 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.504 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.766 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -96.37 172.63 7.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.714 0.293 . . . . 0.0 111.095 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -174.94 134.35 0.35 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.895 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.72 -155.83 19.8 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 82.4 mt-10 -143.64 14.53 1.76 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 110.889 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.46 132.48 26.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 24' ' ' MET . 34.2 m-85 -161.46 148.81 14.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.87 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -94.96 178.84 5.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.127 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.878 HG21 ' HA ' ' A' ' 2' ' ' ILE . 1.9 t -61.03 -34.55 60.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.156 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.634 ' CD ' HD13 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -70.35 -40.44 74.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.578 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 4.7 mm-40 -68.06 -40.96 82.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.917 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.123 HG11 HD11 ' A' ' 84' ' ' LEU . 86.9 t -67.57 -48.75 75.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.179 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.702 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -57.0 -37.27 71.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.882 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -69.67 -33.28 72.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 26.2 m-85 -74.95 -39.3 61.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.955 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -51.25 -59.44 4.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.905 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.459 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.86 -48.3 62.62 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.525 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 1.027 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -61.33 -37.23 82.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.836 0.351 . . . . 0.0 110.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.43 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 82.6 t80 -63.28 -48.38 78.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.913 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.83 -44.92 98.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.109 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -32.73 74.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.877 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.34 -39.54 76.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.135 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -86.97 -15.24 39.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.862 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.557 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 67.29 67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.96 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.0 mt -127.78 64.37 1.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.896 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 3.5 p90 -166.97 163.71 16.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.9 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 48' ' ' GLU . 6.9 t0 -78.31 101.96 7.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.448 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -46.13 -31.27 2.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 4.8 mm-40 -72.0 -33.05 67.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 45' ' ' ASP . 25.0 tt0 -135.31 92.82 2.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 mp0 -55.28 -32.6 62.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.966 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.604 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -65.33 -9.68 26.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.62 104.12 12.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.873 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.82 HG23 HG12 ' A' ' 70' ' ' VAL . 47.4 t -87.83 148.77 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -119.16 82.22 1.83 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.896 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.825 ' HA ' HD21 ' A' ' 59' ' ' LEU . 5.1 p -57.07 -27.77 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 49.13 -92.46 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.535 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -153.37 22.74 0.75 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.481 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.26 -173.78 4.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.907 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.62 -55.2 8.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.934 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.825 HD21 ' HA ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -60.25 -38.19 82.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.819 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.35 -42.31 97.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.488 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 1.5 pt-20 -71.87 -46.92 56.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.361 . . . . 0.0 110.878 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.468 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.7 OUTLIER -53.63 -44.31 69.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.95 -179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.489 ' CD1' ' SD ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -80.12 -47.33 14.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.956 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.09 29.62 14.64 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.467 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.38 -167.61 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.751 0.31 . . . . 0.0 110.872 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.483 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 2.0 pt20 -104.86 -43.15 5.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.886 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.14 157.79 35.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.893 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.64 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.3 p90 -145.51 147.09 31.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.6 135.99 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.816 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.82 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.62 -40.89 28.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.117 179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.563 ' HE2' HD22 ' B' ' 122' ' ' LEU . 8.9 ttmt -69.34 -8.91 50.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 68.9 m-20 -121.04 91.51 47.97 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.623 0.725 . . . . 0.0 110.872 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.9 Cg_endo -69.75 61.65 1.73 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.668 2.245 . . . . 0.0 112.337 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.641 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.87 -70.3 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.636 0.732 . . . . 0.0 110.887 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.641 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.79 -26.95 26.93 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.737 2.292 . . . . 0.0 112.352 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.74 HD22 ' CD2' ' B' ' 126' ' ' LEU . 7.3 tp -58.46 -50.94 71.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -68.79 -43.4 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.18 -43.22 64.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.843 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.489 ' SD ' ' CD1' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -73.65 -49.59 25.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 86.8 mt -53.16 -32.53 48.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.93 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.41 -55.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.857 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -1.71 22.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -92.45 -54.85 3.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.842 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.123 HD11 HG11 ' A' ' 30' ' ' VAL . 2.4 tp -77.3 95.81 4.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 8' ' ' LYS . 9.0 t -61.17 99.36 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.579 HG23 ' O ' ' A' ' 84' ' ' LEU . 18.0 p -99.27 161.87 13.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.157 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.567 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -119.41 173.22 7.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.567 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 75.97 37.98 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.092 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -88.49 142.32 27.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.947 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.4 OUTLIER -132.67 -72.99 0.51 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.877 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.88 -152.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.125 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -37.54 -43.55 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.99 -42.98 39.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.924 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' B' ' 118' ' ' THR . 11.3 t0 -49.91 -65.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.563 HD22 ' HE2' ' A' ' 71' ' ' LYS . 3.0 mt -76.77 -55.09 5.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.951 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 30.0 t-105 -34.07 -57.27 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.931 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt -42.13 -43.91 3.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.904 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.554 HD13 ' CG ' ' A' ' 71' ' ' LYS . 4.7 tt -42.22 -47.4 4.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.74 ' CD2' HD22 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -42.6 102.59 0.28 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.604 0.716 . . . . 0.0 110.96 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 91.62 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.692 2.261 . . . . 0.0 112.373 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -38.32 -33.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.942 ' O ' HG11 ' A' ' 27' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.795 0.331 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.772 HD11 ' C ' ' B' ' 128' ' ' GLU . 45.8 mm -130.9 40.34 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.662 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -114.54 -168.89 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.883 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 19.0 mp0 -73.44 179.44 4.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.897 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 34.5 m -158.51 172.06 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.545 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.7 ttp180 -139.56 92.77 10.1 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.655 0.74 . . . . 0.0 110.863 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 109.55 2.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.698 2.266 . . . . 0.0 112.334 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -67.96 -166.91 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.887 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -53.09 -60.94 5.6 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 110.904 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.7 -2.31 9.91 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.712 2.274 . . . . 0.0 112.377 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.731 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -110.3 -20.74 12.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.922 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.715 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.07 -40.87 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.899 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.5 mtpt -65.44 -27.24 68.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.866 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.5 mm -60.93 -56.01 20.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.111 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.731 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.18 -40.3 71.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.945 179.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.715 ' CD2' HD22 ' A' ' 12' ' ' LEU . 9.2 m170 -55.08 -43.97 74.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.883 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.72 -43.05 80.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.125 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.748 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.08 -12.58 61.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.075 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 123.77 -7.55 8.85 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.484 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.762 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -63.98 173.12 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.773 0.32 . . . . 0.0 111.054 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.49 126.87 0.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.891 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.419 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 142.38 -153.0 24.18 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.486 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -145.74 15.5 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.842 0.353 . . . . 0.0 110.874 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -160.12 139.11 10.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.895 ' O ' HG22 ' A' ' 5' ' ' VAL . 20.2 m-85 -161.82 165.84 27.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.886 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.703 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.75 173.13 7.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.166 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.942 HG11 ' O ' ' A' ' 1' ' ' GLN . 2.5 t -53.21 -45.99 55.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.141 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -65.09 -44.66 88.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.904 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.586 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 38.3 mm-40 -62.86 -39.33 94.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.83 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 68.8 t -67.31 -44.64 87.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.166 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.865 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -69.32 -43.46 73.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.855 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -50.89 -32.78 21.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.851 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.762 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 29.8 m-85 -75.32 -35.92 61.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.888 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -50.42 -58.76 4.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.36 -47.48 62.2 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.511 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.748 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 23.6 mm100 -60.31 -38.68 84.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.862 0.363 . . . . 0.0 110.918 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -63.25 -47.41 82.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.935 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 52' ' ' VAL . 56.6 mt -60.63 -46.17 96.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -33.86 76.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.884 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.76 -38.89 77.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.13 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -15.38 40.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.887 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.48 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.24 55.96 1.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.488 ' CD2' ' HB2' ' A' ' 57' ' ' ASP . 2.3 tp -116.34 62.48 0.71 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.907 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.409 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 19.1 p90 -159.86 164.42 33.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.927 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 4.6 t70 -76.27 105.66 7.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.83 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.409 ' NE2' ' O ' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -48.98 -23.93 1.31 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.911 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.451 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.1 mp0 -77.23 -35.08 55.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.866 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 37.8 mt-10 -134.78 90.31 2.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.5 mp0 -52.78 -20.94 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.95 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.63 ' HA ' HG22 ' A' ' 70' ' ' VAL . 1.7 p-80 -88.76 21.16 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.867 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.485 ' CE ' ' O ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -137.52 87.87 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.974 HG23 HG12 ' A' ' 70' ' ' VAL . 77.4 t -72.26 159.94 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.545 ' N ' HG12 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -133.52 83.31 2.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.93 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.553 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -46.35 -43.54 16.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.873 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 55.63 -84.85 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.462 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.01 25.33 0.26 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.449 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.488 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -85.72 -179.24 6.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.846 0.355 . . . . 0.0 110.837 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 58' ' ' LEU . 9.7 mt -46.63 -55.78 7.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -58.49 -36.23 73.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.748 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.83 -46.78 71.43 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.436 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -64.02 -39.4 94.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 tp -65.35 -50.94 63.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.944 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.623 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -57.9 -53.86 53.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.935 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.09 -4.86 35.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.476 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -98.55 -159.68 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.856 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.1 -41.18 3.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.6 p -157.24 151.15 24.52 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.853 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 16.4 p90 -146.44 155.18 42.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.84 144.18 31.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.815 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.974 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -72.64 -30.87 35.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.151 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 4.3 ptpt -74.82 -9.15 58.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.5 87.81 37.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.579 0.704 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.76 53.75 1.12 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.701 2.268 . . . . 0.0 112.329 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.624 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.08 -69.6 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.647 0.737 . . . . 0.0 110.835 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.624 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.61 27.24 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.696 2.264 . . . . 0.0 112.365 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.0 tp -60.49 -56.52 20.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -66.84 -39.62 87.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -39.2 69.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.623 ' SD ' HD12 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -75.9 -50.42 15.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.937 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.001 HD23 ' ND2' ' A' ' 83' ' ' ASN . 87.2 mt -54.16 -31.27 52.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.913 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -36.58 -55.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.76 -1.4 22.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 1.001 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -94.16 -54.04 3.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.883 179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.722 ' CD2' HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -73.84 95.65 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.949 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.545 HG11 ' CB ' ' A' ' 6' ' ' ARG . 14.7 t -44.9 135.85 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.129 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 13.6 p -134.9 140.24 45.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.14 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.0 mp -112.65 50.3 0.88 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -123.14 19.1 9.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.056 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.09 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 89.9 p . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.779 0.324 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 59.99 14.83 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.631 ' C ' HG22 ' B' ' 118' ' ' THR . 1.5 mm-40 -114.05 148.92 36.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.884 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.724 HG23 ' H ' ' B' ' 119' ' ' PHE . 0.1 OUTLIER 160.68 -65.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.155 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.724 ' H ' HG23 ' B' ' 118' ' ' THR . 0.6 OUTLIER -64.14 -39.57 94.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -19.21 59.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.884 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -73.81 -55.63 5.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.856 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.485 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -83.77 -47.1 11.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.949 ' O ' HD12 ' B' ' 126' ' ' LEU . 37.2 t-105 -37.42 -58.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -42.03 60.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 6.8 tp -44.03 -31.19 0.86 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.91 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.949 HD12 ' O ' ' B' ' 123' ' ' TRP . 0.9 OUTLIER -37.82 124.02 0.99 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.622 0.725 . . . . 0.0 110.913 179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.477 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.77 66.87 1.76 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.682 2.254 . . . . 0.0 112.343 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.772 ' C ' HD11 ' A' ' 2' ' ' ILE . 7.2 mm-40 -37.99 -52.93 1.38 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.555 ' N ' HD11 ' A' ' 2' ' ' ILE . 4.9 m120 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.726 0.298 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.72 HD12 ' HD3' ' A' ' 28' ' ' LYS . 5.9 mm -70.56 90.1 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.146 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.78 ' OD1' ' HB2' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -90.51 -174.22 4.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.899 179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.548 ' HB2' HD13 ' A' ' 87' ' ' LEU . 13.0 mp0 -99.63 -179.72 4.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.926 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.006 HG22 ' O ' ' A' ' 25' ' ' PHE . 11.2 m -147.41 170.84 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.114 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.799 ' CB ' HG11 ' A' ' 85' ' ' VAL . 1.2 ttt180 -148.14 83.1 7.39 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 0.0 110.872 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.7 Cg_endo -69.79 107.48 1.87 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.638 2.226 . . . . 0.0 112.363 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -66.44 -178.02 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.66 -58.89 4.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.594 0.712 . . . . 0.0 110.922 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.8 -2.7 10.64 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.705 2.27 . . . . 0.0 112.325 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.729 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.45 -16.59 12.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.908 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.766 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.46 -41.96 37.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.925 179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -26.83 68.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.922 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.9 mm -61.97 -56.3 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.109 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.23 -36.37 71.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.766 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.8 m170 -56.92 -47.93 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.08 -33.82 73.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.672 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.65 -8.85 58.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.051 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.53 17.79 5.96 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.477 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -93.07 178.34 5.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.34 130.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.923 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 143.64 -113.71 0.78 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.473 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -175.32 -35.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.899 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.601 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -122.56 143.87 49.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 1.006 ' O ' HG22 ' A' ' 5' ' ' VAL . 21.2 m-85 -155.7 169.6 23.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.911 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -96.44 173.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.146 -179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.3 t -54.71 -43.29 65.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.72 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -66.16 -50.35 64.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -52.0 -51.4 57.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.85 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.004 ' CG2' HG21 ' A' ' 5' ' ' VAL . 53.7 t -61.6 -48.82 87.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.111 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.484 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -59.15 -35.9 74.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.894 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.421 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.5 t60 -61.47 -35.22 77.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.892 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 40.7 m-85 -75.15 -32.25 61.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.949 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -50.36 -59.9 3.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.909 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.491 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.23 -48.04 65.46 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.485 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.672 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 3.0 mt-30 -58.49 -39.35 79.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.779 0.324 . . . . 0.0 110.921 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.403 ' O ' HG12 ' A' ' 40' ' ' VAL . 60.3 t80 -64.93 -47.01 79.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.963 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.34 -47.05 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -34.98 79.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -66.28 -38.65 82.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.157 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.47 -15.89 34.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.484 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 69.49 70.31 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.702 ' CD1' HD21 ' A' ' 59' ' ' LEU . 22.3 mt -129.16 60.01 1.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.883 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -160.23 159.81 31.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.952 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -77.33 105.79 8.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.869 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.463 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -46.2 -29.03 1.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.948 -179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.463 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 5.7 mm-40 -80.18 -33.98 37.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.929 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 69.7 mt-10 -132.47 83.15 2.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -54.48 -18.69 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.497 ' CE1' ' HG2' ' A' ' 48' ' ' GLU . 2.6 p-80 -75.68 -0.11 19.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.846 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.89 111.01 13.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.879 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.858 HG23 HG12 ' A' ' 70' ' ' VAL . 58.7 t -86.1 140.11 16.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.1 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.429 ' O ' ' N ' ' A' ' 55' ' ' GLY . 6.2 m-85 -114.39 52.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.933 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.552 ' CB ' HD12 ' A' ' 59' ' ' LEU . 31.1 p -38.22 -30.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.861 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 56.24 -95.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.481 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.15 10.9 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.493 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.95 177.57 0.76 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 110.907 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.6 mp -46.63 -55.67 7.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.933 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 43' ' ' LEU . 1.7 pp -60.81 -39.48 89.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -59.45 -49.03 82.97 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.458 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.33 -35.93 78.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.87 0.367 . . . . 0.0 110.849 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.48 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -65.49 -36.2 83.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.917 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.2 OUTLIER -78.04 -40.35 39.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.78 -11.1 59.18 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.45 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.6 151.98 23.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.888 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.443 ' O ' ' N ' ' A' ' 55' ' ' GLY . 28.2 mt-30 -70.94 -36.31 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.0 p -157.12 138.25 13.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 31.5 p90 -128.13 155.45 44.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 57.7 m -96.16 139.6 32.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.875 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.858 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -77.53 -40.76 28.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.108 179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.536 ' HE2' HD21 ' B' ' 122' ' ' LEU . 9.4 ttmt -65.21 -10.35 30.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.883 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -123.74 91.77 49.32 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.558 0.694 . . . . 0.0 110.813 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 59.64 1.66 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.274 . . . . 0.0 112.299 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.621 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.02 -70.34 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 0.0 110.872 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.621 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.86 -27.51 25.92 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.254 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.8 tp -57.77 -53.38 58.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.909 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.18 -34.2 77.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -46.43 89.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.899 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.524 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 2.8 ttp -70.37 -50.54 37.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.833 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.7 ' CD2' HD23 ' A' ' 84' ' ' LEU . 62.8 mt -55.75 -38.99 70.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.927 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -35.69 -56.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.882 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.404 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.65 -1.42 19.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.62 ' O ' HD21 ' A' ' 11' ' ' LEU . 47.9 t30 -96.47 -49.61 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.863 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.865 ' HG ' HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -98.51 95.91 7.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.904 179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.799 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.6 t -37.17 142.15 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.131 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.5 p -148.71 123.1 9.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.153 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.548 HD13 ' HB2' ' A' ' 4' ' ' GLN . 3.6 mp -90.73 92.73 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.874 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.78 ' HB2' ' OD1' ' A' ' 3' ' ' ASN . . . -137.31 -157.87 0.81 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.13 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.133 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.824 0.345 . . . . 0.0 110.838 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -169.26 54.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.88 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -99.62 127.63 45.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.667 HG23 ' N ' ' B' ' 119' ' ' PHE . 3.7 t -173.45 -156.05 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.179 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.667 ' N ' HG23 ' B' ' 118' ' ' THR . 2.9 t80 -49.74 -32.4 13.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . 0.613 ' H ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -67.68 -27.86 67.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.896 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -105.86 -13.05 15.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.872 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.536 HD21 ' HE2' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -102.38 -50.99 3.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.911 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.627 ' CE3' ' CZ ' ' B' ' 119' ' ' PHE . 38.9 t-105 -36.3 -58.77 0.67 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.415 ' O ' ' C ' ' B' ' 125' ' ' LEU . 5.6 ptmt -50.96 -39.39 55.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.47 ' CB ' ' O ' ' B' ' 122' ' ' LEU . 4.4 tt -36.43 -34.47 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.922 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.792 HD11 ' O ' ' A' ' 70' ' ' VAL . 2.6 mp -46.67 164.44 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.611 0.72 . . . . 0.0 110.866 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 64.7 1.77 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.487 ' O ' ' CB ' ' B' ' 129' ' ' ASN . 4.1 pt-20 -120.4 99.89 6.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' B' ' 128' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.715 ' H3 ' ' CB ' ' B' ' 129' ' ' ASN . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.76 0.314 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.54 HD12 ' HD3' ' A' ' 28' ' ' LYS . 8.7 mm -37.72 154.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.173 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.554 ' H ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -167.73 -179.77 4.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.891 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' OE1' ' CG2' ' A' ' 26' ' ' THR . 40.2 mm-40 -102.46 157.54 16.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.933 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.054 HG11 HD22 ' A' ' 84' ' ' LEU . 17.7 m -141.91 172.12 10.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.534 ' CB ' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -141.57 100.73 6.13 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 0.0 110.837 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 111.18 2.75 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.667 2.245 . . . . 0.0 112.371 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 12' ' ' LEU . 4.4 mmtp -67.96 168.57 11.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.516 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.06 -60.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.56 0.695 . . . . 0.0 110.893 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.77 -23.13 31.09 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.69 2.26 . . . . 0.0 112.325 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -86.72 -12.74 47.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.917 179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 8' ' ' LYS . 2.9 tp -76.94 -54.37 6.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.59 -31.52 25.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.407 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.1 mt -60.11 -54.51 33.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.685 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 18.8 mt -69.68 -41.16 75.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.49 ' CD2' HE21 ' A' ' 21' ' ' GLN . 12.2 m170 -53.7 -47.6 70.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.892 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.07 -17.53 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.033 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.898 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.31 19.95 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.077 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.43 4.98 79.84 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.479 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.775 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -75.88 -177.13 3.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.781 0.324 . . . . 0.0 111.082 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.49 HE21 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 172.07 110.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.961 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.42 -171.11 28.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -120.94 -7.53 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.546 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 5.8 mmt -128.94 141.68 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.888 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.807 ' O ' HG22 ' A' ' 5' ' ' VAL . 60.0 m-85 -161.92 151.74 16.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.772 ' O ' HG23 ' A' ' 30' ' ' VAL . 1.4 p -96.38 172.4 7.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.16 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.554 HG23 ' H ' ' A' ' 3' ' ' ASN . 79.7 t -51.53 -44.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.154 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.54 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -65.15 -41.35 94.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 33.4 mt-10 -64.22 -39.33 93.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.853 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.059 HG11 HD21 ' A' ' 84' ' ' LEU . 15.6 t -67.83 -47.74 78.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.114 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.794 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -58.98 -34.43 71.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 179.913 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -68.64 -32.83 72.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.858 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.775 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.92 -39.9 61.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.886 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -59.28 4.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.452 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.92 -47.88 64.35 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.45 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.898 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.5 mt-30 -60.64 -39.36 88.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.817 0.342 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -62.59 -47.57 83.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.928 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.71 -46.46 95.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.142 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.527 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.26 -34.15 77.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.895 179.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.3 -39.04 78.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt -87.14 -14.73 40.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.92 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.533 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.82 54.97 1.27 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 57' ' ' ASP . 3.8 tp -111.07 42.95 1.53 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.527 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.4 p90 -148.11 167.22 25.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.895 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.96 124.52 33.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.893 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.783 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.6 OUTLIER -62.31 -37.24 84.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.504 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.3 OUTLIER -59.19 -28.18 66.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.889 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.6 ' CD ' ' CE1' ' A' ' 50' ' ' HIS . 3.7 mm-40 -143.05 96.01 2.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.917 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -56.89 -24.14 49.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.924 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.6 ' CE1' ' CD ' ' A' ' 48' ' ' GLU . 1.9 p-80 -85.43 9.82 14.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.822 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 95.48 4.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.74 HG23 HG12 ' A' ' 70' ' ' VAL . 49.6 t -87.83 130.99 36.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 11.9 m-85 -114.82 74.96 0.9 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.514 ' HA ' HD21 ' A' ' 59' ' ' LEU . 1.7 p -54.0 -33.1 56.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.889 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 58.96 -81.24 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.484 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -160.14 23.02 0.27 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.464 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.496 ' HB2' HD21 ' A' ' 43' ' ' LEU . 4.2 t0 -78.46 -173.28 3.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.866 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -46.62 -55.92 6.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.941 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.749 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -61.83 -41.4 97.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.749 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -59.97 -41.2 97.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.468 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -72.55 -38.29 68.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.895 0.379 . . . . 0.0 110.893 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -61.5 -43.64 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.942 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.481 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -74.41 -47.6 32.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.893 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.52 23.66 15.77 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.43 -154.16 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.31 . . . . 0.0 110.869 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.433 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -120.55 -43.56 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.29 154.42 29.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.85 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.735 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 11.8 p90 -145.65 150.23 35.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.884 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.72 137.17 32.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.835 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.74 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.04 -36.93 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.11 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.511 ' HZ1' ' CE1' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -68.82 -20.57 64.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.892 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 25.2 t0 -112.88 90.32 15.24 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 0.0 110.866 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.8 61.83 1.77 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.671 2.247 . . . . 0.0 112.343 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.644 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.76 -70.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.63 0.729 . . . . 0.0 110.841 -179.838 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.644 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.8 Cg_endo -69.78 -26.95 26.97 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.667 2.245 . . . . 0.0 112.354 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.788 HD22 HD21 ' B' ' 126' ' ' LEU . 7.9 tp -58.52 -49.88 75.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.922 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.88 -40.47 79.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.937 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 1.3 t0 -56.18 -39.3 72.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.486 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -76.39 -47.64 22.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.924 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.798 HD22 ' CD1' ' A' ' 84' ' ' LEU . 87.7 mt -53.55 -37.01 62.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 4.2 mtp85 -34.98 -57.84 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.69 -1.22 19.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.891 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' ' 80' ' ' LEU . 2.5 t30 -92.72 -51.27 5.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.909 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.059 HD21 HG11 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -74.39 95.78 2.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.534 HG11 ' CB ' ' A' ' 6' ' ' ARG . 25.1 t -37.51 142.96 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.628 ' C ' HD23 ' A' ' 87' ' ' LEU . 17.3 p -139.52 152.74 47.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.156 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD23 ' C ' ' A' ' 86' ' ' THR . 0.0 OUTLIER -119.34 -38.39 3.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -94.71 132.79 39.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.14 -179.904 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.14 -169.94 2.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.88 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -163.02 -40.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.469 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER -74.27 -153.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.189 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.602 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -40.92 -42.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.881 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 2.8 m -50.45 -39.23 47.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.846 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -51.81 -65.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.907 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -78.69 -52.92 7.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.602 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.5 t-105 -35.33 -56.84 0.62 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.967 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -46.78 -42.85 17.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.923 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.444 ' N ' ' O ' ' B' ' 122' ' ' LEU . 12.3 tp -41.69 -47.57 4.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.942 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.794 HD23 ' CE ' ' A' ' 31' ' ' MET . 1.2 tp -42.29 102.45 0.27 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.727 . . . . 0.0 110.865 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' B' ' 126' ' ' LEU . 53.4 Cg_endo -69.82 85.14 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.667 2.244 . . . . 0.0 112.324 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.462 ' O ' ' CB ' ' B' ' 129' ' ' ASN . 1.9 mp0 -46.67 -24.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.715 ' CB ' ' H3 ' ' A' ' 1' ' ' GLN . 1.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.886 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.821 0.343 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.773 HD12 ' HD3' ' A' ' 28' ' ' LYS . 19.0 mm -131.94 65.47 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.144 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.534 ' OD1' ' HB2' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -108.76 -175.78 2.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.948 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.493 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -68.19 -179.38 1.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.915 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -152.17 175.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.08 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.713 ' O ' HG21 ' A' ' 85' ' ' VAL . 1.7 ttt85 -162.87 90.94 1.24 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.592 0.711 . . . . 0.0 110.839 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD3' HG13 ' A' ' 5' ' ' VAL . 53.5 Cg_endo -69.8 131.9 22.14 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.683 2.255 . . . . 0.0 112.333 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -75.6 -169.95 1.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.3 tp -58.37 -59.41 13.54 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.566 0.698 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.0 Cg_endo -69.72 -2.69 10.58 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.689 2.259 . . . . 0.0 112.337 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mp -109.54 -25.7 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.938 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.768 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -63.92 -46.6 84.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.919 179.912 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -30.05 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.949 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mt -62.12 -55.07 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.098 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.587 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 2.8 mm? -66.32 -42.51 88.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.768 ' CD2' HD22 ' A' ' 12' ' ' LEU . 8.4 m170 -55.81 -49.64 72.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.846 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.49 -13.48 52.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.113 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.714 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.74 9.4 41.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.105 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.46 10.5 47.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.976 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.6 177.72 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.721 0.296 . . . . 0.0 111.102 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HA ' ' NE2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 173.32 121.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.93 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 152.78 -106.29 0.3 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.436 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 179.05 -33.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.599 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.29 142.69 41.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.91 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.599 ' CD1' ' C ' ' A' ' 24' ' ' MET . 55.3 m-85 -161.96 155.78 21.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -97.82 -179.87 4.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.178 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.565 HG21 ' HA ' ' A' ' 2' ' ' ILE . 2.1 t -60.78 -42.31 91.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.099 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.773 ' HD3' HD12 ' A' ' 2' ' ' ILE . 1.3 mppt? -62.29 -44.44 96.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.905 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.492 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.5 OUTLIER -61.85 -55.34 30.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.873 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 26' ' ' THR . 47.8 t -52.57 -45.06 46.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.118 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.631 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -66.61 -43.15 85.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.894 179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.7 t60 -63.45 -30.45 71.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.976 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 42.1 m-85 -75.35 -30.52 60.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.08 -54.92 17.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.48 60.3 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.5 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.714 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -59.76 -42.82 94.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.837 0.351 . . . . 0.0 110.948 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.569 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 88.7 t80 -60.07 -48.4 81.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 mt -59.28 -49.71 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.074 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.57 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -61.64 -33.49 74.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.843 179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.46 -36.83 62.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -86.89 -12.84 46.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.499 ' NE2' ' N ' ' A' ' 42' ' ' GLN . 0.2 OUTLIER 64.95 63.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.932 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -128.18 57.97 1.55 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.925 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.57 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -161.03 162.72 31.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.861 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' OD1' ' HG2' ' A' ' 47' ' ' GLN . 4.8 t0 -78.83 113.95 17.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.778 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -58.93 -21.38 57.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 -179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.545 ' NE2' ' CB ' ' A' ' 46' ' ' GLN . 5.0 mm-40 -87.02 -21.96 25.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.876 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.582 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 73.4 mt-10 -147.96 81.62 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.451 ' O ' HG11 ' A' ' 70' ' ' VAL . 1.5 mm-40 -54.05 -18.0 3.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.966 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.707 ' HB3' HD13 ' B' ' 122' ' ' LEU . 9.8 p-80 -75.89 1.65 14.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.849 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.592 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -126.58 90.72 3.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.857 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.983 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 79.1 t -65.65 140.48 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.078 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -118.16 80.35 1.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.937 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.625 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -53.04 -41.03 64.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.868 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.437 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.89 -79.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.462 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.85 22.66 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.478 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.3 176.98 9.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.819 0.342 . . . . 0.0 110.861 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -46.71 -51.21 16.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.901 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.801 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.1 pt? -60.76 -38.97 87.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.917 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.801 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -60.52 -45.41 96.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.47 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.488 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pt-20 -67.49 -47.18 70.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.885 0.374 . . . . 0.0 110.857 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.68 -36.73 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.872 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.62 -34.16 46.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.889 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.63 1.95 87.38 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.455 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 7.7 mmt180 -101.02 -154.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -125.45 -42.64 1.95 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.962 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -157.03 147.78 21.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.824 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.983 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 36.8 p90 -139.71 147.32 40.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.86 136.23 33.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.939 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.37 -32.01 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.168 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.484 ' CE ' ' HB3' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -73.6 -11.34 60.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.406 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 53.7 t0 -123.07 91.37 49.89 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.592 0.711 . . . . 0.0 110.854 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.2 Cg_endo -69.85 58.84 1.63 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.675 2.25 . . . . 0.0 112.311 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.643 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.19 -70.35 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.658 0.742 . . . . 0.0 110.871 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.643 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.79 -26.9 26.96 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.732 2.288 . . . . 0.0 112.337 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.593 HD21 ' CE ' ' A' ' 31' ' ' MET . 3.9 tp -58.82 -56.21 25.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.492 ' HH ' ' C ' ' B' ' 128' ' ' GLU . 24.6 m-85 -62.26 -40.24 95.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.888 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.76 -40.74 69.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.858 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 4.3 ttp -73.79 -49.86 23.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.879 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.019 HD22 ' CD2' ' A' ' 84' ' ' LEU . 84.5 mt -54.66 -31.19 57.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -43.12 -50.28 6.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.913 179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.486 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.89 -1.3 22.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.816 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -98.36 -52.14 3.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.921 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD2' HD22 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -58.96 150.42 24.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.752 ' O ' HG22 ' A' ' 5' ' ' VAL . 0.3 OUTLIER -117.4 85.08 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.118 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.3 p -100.31 153.04 19.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.138 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.629 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 3.1 mp -112.66 95.39 5.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.629 ' HB2' ' O ' ' A' ' 87' ' ' LEU . . . 166.23 72.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.155 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.809 0.337 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 47' ' ' GLN . 2.0 tt0 -178.01 82.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -129.79 179.54 5.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 2.2 m -84.22 148.58 26.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.145 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.481 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -43.45 -57.76 2.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.894 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -23.3 12.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.84 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -56.75 4.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.877 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.812 HD12 ' CG2' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -81.17 -51.53 8.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.873 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.562 ' O ' HD12 ' B' ' 126' ' ' LEU . 23.6 t-105 -34.42 -58.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.918 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.74 -43.36 47.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.856 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.536 ' O ' HD23 ' B' ' 125' ' ' LEU . 3.9 tt -40.97 -38.6 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.929 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.631 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -37.01 142.36 0.37 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.61 0.719 . . . . 0.0 110.937 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.476 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 53.7 Cg_endo -69.71 -14.45 36.26 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 0.0 112.366 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.492 ' C ' ' HH ' ' A' ' 77' ' ' TYR . 0.3 OUTLIER 75.7 -55.38 0.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.548 HD12 ' HD3' ' A' ' 28' ' ' LYS . 5.2 mm -97.47 99.14 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.623 ' O ' HG23 ' A' ' 27' ' ' VAL . 6.3 t-20 -88.04 154.49 20.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.893 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.454 ' H ' ' ND2' ' A' ' 3' ' ' ASN . 2.8 mp0 -73.43 -179.07 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.77 HG21 HG21 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -148.94 175.08 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.097 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.784 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.4 OUTLIER -155.6 90.29 2.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.651 0.738 . . . . 0.0 110.898 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HD3' HG13 ' A' ' 5' ' ' VAL . 54.3 Cg_endo -69.7 110.16 2.47 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.726 2.284 . . . . 0.0 112.339 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 4.7 mtmm -70.64 -154.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.849 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.6 tp -69.5 -60.84 3.6 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.587 0.708 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.81 -3.19 11.55 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.685 2.257 . . . . 0.0 112.318 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.887 HD11 ' O ' ' A' ' 83' ' ' ASN . 1.6 mt -104.34 -46.09 4.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp -48.25 -38.47 18.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.932 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -29.5 69.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.9 mm -61.03 -56.05 20.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.16 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.716 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.89 -34.98 72.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.959 179.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.485 ' CD2' ' CD1' ' A' ' 12' ' ' LEU . 3.0 m170 -57.1 -49.6 75.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.83 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.14 87.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.107 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -66.55 -11.67 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.127 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 114.07 23.83 4.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.457 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.893 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -96.86 -176.86 3.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 120.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.05 -163.81 28.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.51 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -134.46 7.44 3.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.848 0.356 . . . . 0.0 110.909 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.598 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.31 136.45 26.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.837 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.598 ' CD1' ' C ' ' A' ' 24' ' ' MET . 29.4 m-85 -162.17 158.28 24.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.94 177.8 5.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.116 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 3' ' ' ASN . 2.0 t -55.06 -40.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.114 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.548 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.58 -50.79 41.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.892 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.587 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 39.9 mt-10 -53.36 -38.94 63.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.905 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.993 ' CG1' HD21 ' A' ' 84' ' ' LEU . 38.6 t -74.53 -58.05 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.944 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.2 OUTLIER -52.08 -37.49 54.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.885 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.444 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.8 t60 -59.56 -35.56 74.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.893 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 34.1 m-85 -75.23 -29.95 60.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.897 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -54.11 -60.19 3.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' B' ' 119' ' ' PHE . . . -53.65 -47.68 63.42 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.491 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.95 -42.13 97.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.978 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -59.0 -47.95 83.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.7 mt -60.77 -48.23 89.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.493 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.44 -36.64 84.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.815 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.19 -38.92 81.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.154 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.9 mmpt? -84.64 -15.7 44.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.943 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.685 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.96 60.85 0.52 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mt -123.84 61.86 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.937 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.555 ' CZ ' ' OE1' ' A' ' 46' ' ' GLN . 1.3 p90 -170.17 169.31 7.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.9 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.15 112.27 19.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.876 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.555 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -56.52 -23.82 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.439 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 8.4 mm-40 -78.44 -35.49 46.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.928 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.42 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 55.0 mm-40 -133.35 87.7 2.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' OE1' ' O ' ' B' ' 117' ' ' GLU . 9.0 mp0 -55.1 -20.48 9.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.947 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.941 ' HB3' HD13 ' B' ' 122' ' ' LEU . 5.9 p-80 -73.4 -2.85 24.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.793 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.96 93.58 4.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.882 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.936 HG23 HG12 ' A' ' 70' ' ' VAL . 26.6 t -79.13 136.95 22.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.073 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -107.42 59.83 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.767 ' HA ' HD21 ' A' ' 59' ' ' LEU . 3.8 p -50.19 -50.85 48.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.84 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -36.86 95.03 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.532 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 143.92 -14.3 2.16 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.26 176.22 6.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.855 0.36 . . . . 0.0 110.864 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.57 -47.66 39.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.938 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.829 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -61.18 -35.79 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.829 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.88 -61.98 4.85 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.468 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.7 -43.68 69.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.898 0.38 . . . . 0.0 110.889 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' O ' HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -59.76 -54.78 42.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.929 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' HB2' ' A' ' 79' ' ' MET . 0.4 OUTLIER -51.45 -49.71 61.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 109.07 -10.48 34.06 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.489 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -96.64 -154.11 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.732 0.301 . . . . 0.0 110.878 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -129.46 -38.94 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.966 -179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.8 p -157.55 137.29 12.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.913 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.637 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 6.5 p90 -131.61 144.48 51.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.891 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 71.0 m -83.21 136.62 34.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.859 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.936 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -73.42 -32.27 36.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.146 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.798 ' CD ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.11 -20.29 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.92 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 24.3 t0 -115.95 89.67 25.3 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.825 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.482 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.7 Cg_endo -69.8 61.16 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.673 2.249 . . . . 0.0 112.341 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.628 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.4 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 0.0 110.857 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.628 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.74 -27.19 26.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.71 2.273 . . . . 0.0 112.296 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 80' ' ' LEU . 2.7 tp -58.41 -58.56 7.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.928 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.8 m-85 -60.98 -36.93 80.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.951 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -58.29 -38.02 76.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.836 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.494 ' HB2' ' CD2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.8 -53.32 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.777 ' HG ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -53.81 -32.06 51.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.928 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -34.98 -55.87 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.85 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.26 -2.11 21.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.887 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -93.7 -54.44 3.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.896 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.993 HD21 ' CG1' ' A' ' 30' ' ' VAL . 1.1 tp -86.9 95.95 10.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.784 HG11 ' HB3' ' A' ' 6' ' ' ARG . 2.3 t -42.84 135.03 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 84' ' ' LEU . 17.6 p -132.95 130.08 39.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.167 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.664 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -95.76 118.91 33.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 63.97 113.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.116 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 9.5 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.806 0.336 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.64 153.59 47.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 49' ' ' GLN . 1.3 mt-10 -133.63 138.55 45.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 121' ' ' ASP . 1.3 m -137.22 146.04 44.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.437 ' O ' ' HB2' ' B' ' 123' ' ' TRP . 0.2 OUTLIER -44.06 -59.01 2.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.896 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.37 -20.85 8.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.858 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.414 ' CB ' ' O ' ' B' ' 118' ' ' THR . 1.2 t70 -71.47 -61.72 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.941 HD13 ' HB3' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -79.83 -46.36 17.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.946 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.454 ' NE1' ' SD ' ' A' ' 31' ' ' MET . 26.1 t-105 -34.82 -58.54 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' B' ' 125' ' ' LEU . 0.2 OUTLIER -45.72 -42.76 12.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.878 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' B' ' 122' ' ' LEU . 59.5 mt -36.57 -46.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' CE ' ' A' ' 31' ' ' MET . 0.2 OUTLIER -37.42 136.94 0.67 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.593 0.711 . . . . 0.0 110.93 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.482 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.0 Cg_endo -69.7 -0.2 6.52 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.706 2.271 . . . . 0.0 112.323 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.481 ' CG ' ' HG2' ' A' ' 31' ' ' MET . 0.0 OUTLIER -32.15 -39.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.891 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.434 ' N ' ' O ' ' B' ' 127' ' ' PRO . 5.1 t-20 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.915 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.475 ' C ' HD13 ' A' ' 2' ' ' ILE . 5.0 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.767 0.318 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.692 HG22 HG21 ' A' ' 26' ' ' THR . 2.7 mm -94.71 72.05 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.117 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.39 136.31 34.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.593 ' OE1' HG23 ' A' ' 26' ' ' THR . 13.1 mm-40 -68.0 162.16 25.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.886 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.735 ' CG1' HD21 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -147.01 167.57 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.172 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.471 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -137.81 103.07 8.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.617 0.722 . . . . 0.0 110.885 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 111.17 2.72 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.673 2.248 . . . . 0.0 112.396 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' O ' ' N ' ' A' ' 12' ' ' LEU . 14.1 mtpt -63.17 169.27 3.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.549 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -40.72 -57.53 3.12 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.611 0.72 . . . . 0.0 110.909 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.78 -14.21 35.71 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.684 2.256 . . . . 0.0 112.317 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.469 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 8.1 mt -102.58 -8.21 21.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.764 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.54 -54.29 6.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.899 179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.64 -32.95 31.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 2.9 mt -58.38 -54.51 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.136 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.643 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 11.5 mt -70.76 -37.36 73.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.764 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -58.54 -49.44 77.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.865 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.99 -13.58 17.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.931 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -98.76 17.47 19.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.126 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.47 9.08 67.27 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.529 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.833 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -91.72 172.32 8.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.739 0.304 . . . . 0.0 111.113 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -172.61 132.75 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.466 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 131.79 -152.32 20.07 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.454 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -143.91 14.52 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.538 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 9.5 mmt -147.9 138.03 22.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.538 ' CG ' ' O ' ' A' ' 24' ' ' MET . 47.6 m-85 -161.83 150.88 15.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.778 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -91.87 -177.7 4.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.123 -179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.52 -41.51 79.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.629 ' HD3' HD12 ' A' ' 2' ' ' ILE . 0.9 OUTLIER -72.46 -49.69 31.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.6 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 1.6 mm-40 -59.5 -33.9 71.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.778 HG23 ' O ' ' A' ' 26' ' ' THR . 93.7 t -75.36 -48.35 31.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.114 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.751 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -63.63 -41.5 98.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.867 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.544 ' CE1' ' HE2' ' B' ' 124' ' ' LYS . 1.8 t60 -55.36 -29.88 59.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.842 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.833 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.8 m-85 -74.48 -34.8 63.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.45 -55.51 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.885 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.49 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.15 -47.97 65.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.484 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.931 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -61.0 -45.03 96.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.862 0.363 . . . . 0.0 110.975 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.523 ' OH ' HD23 ' A' ' 58' ' ' LEU . 93.0 t80 -57.04 -49.81 74.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.913 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.8 mt -58.76 -48.61 85.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.128 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -36.38 83.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.55 -38.21 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.123 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -88.12 -15.92 34.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.421 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.01 67.76 0.52 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.949 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 1.009 HD13 HD21 ' A' ' 59' ' ' LEU . 6.0 mt -127.53 66.09 1.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -164.78 169.5 16.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.945 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.48 115.11 18.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.906 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -58.34 -16.02 12.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.923 -179.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.8 mm-40 -84.83 -29.17 25.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.893 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.52 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 59.3 mt-10 -143.29 93.76 2.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.892 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 -55.68 -17.88 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.93 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.762 ' HB3' HD13 ' B' ' 122' ' ' LEU . 7.9 p-80 -82.17 7.4 13.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.79 98.32 5.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.88 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.954 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.2 t -75.09 141.22 16.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -129.56 70.21 1.42 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.919 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.475 ' O ' HD22 ' A' ' 43' ' ' LEU . 30.5 p -47.83 -45.56 30.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.48 10.58 30.34 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.491 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.38 -17.78 10.33 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.497 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.557 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -47.83 176.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 0.0 110.853 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.651 ' H ' HD22 ' A' ' 58' ' ' LEU . 2.9 mm? -46.49 -55.71 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.893 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 1.009 HD21 HD13 ' A' ' 43' ' ' LEU . 0.5 OUTLIER -55.81 -35.42 66.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.918 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.429 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.68 -43.97 90.7 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.461 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -65.84 -38.47 88.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.912 0.387 . . . . 0.0 110.931 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -69.84 -39.08 76.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.875 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.55 ' CD2' ' CE ' ' A' ' 79' ' ' MET . 0.7 OUTLIER -66.89 -47.04 73.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.952 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.45 ' C ' ' NE ' ' A' ' 65' ' ' ARG . . . 99.77 3.26 56.13 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.508 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.45 ' NE ' ' C ' ' A' ' 64' ' ' GLY . 0.6 OUTLIER -120.5 -153.82 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.839 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -118.2 -33.25 4.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 p -157.83 146.94 19.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.954 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 32.4 p90 -142.33 155.09 45.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.17 136.44 35.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.84 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.703 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -75.13 -31.56 24.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.164 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.823 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.4 ttmt -74.51 -1.07 19.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.946 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 36.1 t70 -136.78 92.61 14.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 0.0 110.885 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.69 62.26 1.72 Allowed 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.701 2.267 . . . . 0.0 112.348 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.615 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.44 -69.11 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.696 0.76 . . . . 0.0 110.847 -179.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.615 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.7 -26.61 27.67 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.369 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.751 HD21 ' CE ' ' A' ' 31' ' ' MET . 10.1 tp -58.5 -60.49 3.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.917 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -53.89 -41.11 67.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.17 -28.83 59.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.55 ' CE ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 tmm? -81.31 -50.59 9.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 76' ' ' LEU . 8.0 mp -55.84 -30.7 61.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.899 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.536 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -41.17 -51.09 3.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.853 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.536 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.65 -0.99 21.55 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.925 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.43 ' N ' ' HD2' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -100.64 -54.43 2.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.735 HD21 ' CG1' ' A' ' 5' ' ' VAL . 6.9 tt -69.94 95.56 0.94 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.3 t -48.22 151.88 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.18 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.494 ' C ' HD23 ' A' ' 87' ' ' LEU . 20.0 p -141.29 121.89 14.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.183 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.719 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.2 OUTLIER -96.75 -36.04 10.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -106.07 112.24 25.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.098 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.1 -166.36 1.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' O ' ' C ' ' B' ' 118' ' ' THR . 0.5 OUTLIER -104.29 -156.62 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.888 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.456 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.61 -152.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.13 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.539 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -38.05 -42.81 0.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.878 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.55 -42.86 34.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.829 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -51.04 -65.07 0.62 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.922 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.823 HD22 ' CE ' ' A' ' 71' ' ' LYS . 5.2 mt -76.87 -57.04 4.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.604 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 31.7 t-105 -32.74 -56.34 0.36 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.886 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.544 ' HE2' ' CE1' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -48.24 -50.28 30.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -48.48 -23.32 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.884 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.595 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 1.4 tp -57.53 127.42 77.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.636 0.731 . . . . 0.0 110.941 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.471 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 54.0 Cg_endo -69.78 65.1 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.671 2.247 . . . . 0.0 112.357 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.473 ' CB ' ' HG3' ' A' ' 28' ' ' LYS . 9.8 mt-10 -40.08 -68.88 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.432 ' C ' ' CD1' ' A' ' 2' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.602 ' O ' HD13 ' A' ' 2' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.718 0.294 . . . . 0.0 110.902 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.602 HD13 ' O ' ' A' ' 1' ' ' GLN . 21.4 mm -137.17 54.31 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.545 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -90.41 131.86 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.862 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.604 ' O ' HG22 ' A' ' 86' ' ' THR . 2.9 mp0 -67.93 169.45 9.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.587 HG12 HG22 ' A' ' 86' ' ' THR . 0.7 OUTLIER -145.27 172.04 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.508 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -146.66 92.76 5.02 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.594 0.711 . . . . 0.0 110.88 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.481 ' HA ' HD23 ' A' ' 11' ' ' LEU . 53.1 Cg_endo -69.78 122.09 8.77 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.691 2.261 . . . . 0.0 112.319 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 1.0 OUTLIER -77.69 -165.54 0.64 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.866 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.519 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -52.12 -60.28 6.55 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.576 0.703 . . . . 0.0 110.928 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -6.57 18.89 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.679 2.253 . . . . 0.0 112.359 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -106.04 -19.08 13.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.935 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.73 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.19 -44.88 28.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -60.59 -29.81 69.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.918 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.5 mt -59.88 -54.58 32.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.798 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.6 mt -70.6 -41.81 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.73 ' CD2' HD22 ' A' ' 12' ' ' LEU . 11.3 m170 -58.07 -49.2 77.74 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.874 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.09 -8.39 30.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.062 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 1.044 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -106.42 5.45 29.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.063 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.13 17.32 20.73 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.798 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -99.68 175.41 5.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.772 0.32 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.453 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.76 132.91 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.449 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 135.1 -154.69 21.69 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.481 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -144.03 14.62 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.83 0.347 . . . . 0.0 110.884 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.602 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -158.0 145.31 18.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.602 ' CD1' ' C ' ' A' ' 24' ' ' MET . 30.2 m-85 -162.04 156.04 21.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.844 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.28 165.0 13.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 27' ' ' VAL . 0.1 OUTLIER -46.13 -52.51 3.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.145 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.531 ' HE2' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -53.98 -48.56 70.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.913 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -57.82 9.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 84' ' ' LEU . 61.9 t -55.34 -33.96 32.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.944 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -70.26 -32.74 70.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -74.25 -33.98 63.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.833 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.562 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 27.6 m-85 -74.48 -36.26 63.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.938 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 30' ' ' VAL . 1.3 mm? -50.55 -58.47 5.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.494 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.09 -48.3 63.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.482 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 1.044 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.8 -37.96 83.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.834 0.349 . . . . 0.0 110.928 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.423 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 87.0 t80 -62.84 -46.4 88.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.955 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.1 mt -62.2 -43.24 97.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.606 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.61 -29.92 67.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -73.32 -38.77 54.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.128 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -89.99 -13.81 35.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 74.21 42.54 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.923 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.769 ' O ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -100.2 53.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -162.81 161.68 26.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 14.2 t70 -80.05 122.61 26.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.463 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -64.7 -10.05 24.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.887 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.492 ' N ' ' OD1' ' A' ' 45' ' ' ASP . 6.0 mm-40 -97.72 -26.09 14.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HB2' ' CE1' ' A' ' 50' ' ' HIS . 18.6 pt-20 -144.33 83.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.439 ' OE1' ' N ' ' B' ' 119' ' ' PHE . 0.9 OUTLIER -54.06 -18.0 3.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.685 ' HB3' HD13 ' B' ' 122' ' ' LEU . 3.7 p-80 -74.45 -0.11 16.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.834 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.453 ' HE1' ' O ' ' A' ' 52' ' ' VAL . 2.6 mmm -126.31 130.96 51.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.901 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 43' ' ' LEU . 86.8 t -113.1 135.16 53.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.17 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.574 ' C ' HD12 ' A' ' 43' ' ' LEU . 7.3 m-85 -111.94 53.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.921 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.456 ' HB2' ' CA ' ' A' ' 60' ' ' GLY . 23.4 p -37.69 -35.29 0.13 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 61.84 -82.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.522 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -152.47 18.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.475 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.85 -178.42 4.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.817 0.341 . . . . 0.0 110.843 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.1 OUTLIER -46.55 -55.89 6.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.926 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.535 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.8 pt? -59.16 -40.0 84.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -62.36 -44.0 98.27 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.52 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.44 -41.4 89.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.908 0.385 . . . . 0.0 110.919 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.794 HD11 ' HB2' ' A' ' 83' ' ' ASN . 40.9 tp -60.81 -50.33 73.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.904 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.681 HD21 ' HB2' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -66.45 -35.78 81.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.936 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.31 -2.92 85.43 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.494 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.507 ' CA ' ' NE ' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -105.8 172.68 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.907 -179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -86.76 -34.86 19.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -157.49 157.96 34.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.83 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 48.7 p90 -148.9 148.11 29.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.894 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.73 140.09 30.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.84 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.532 HG11 ' CE1' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -77.65 -39.87 27.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.099 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 8.9 ttmt -62.73 -12.13 21.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -120.13 95.53 49.12 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 0.0 110.853 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.8 Cg_endo -69.74 53.24 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.709 2.273 . . . . 0.0 112.346 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.612 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.21 -68.89 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.692 0.758 . . . . 0.0 110.848 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.681 ' HB2' HD21 ' A' ' 63' ' ' LEU . 53.1 Cg_endo -69.78 -26.79 27.13 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.681 2.254 . . . . 0.0 112.314 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.821 HD22 HD21 ' B' ' 126' ' ' LEU . 16.0 tp -60.76 -58.58 7.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.943 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.41 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 54.8 m-85 -66.87 -42.11 86.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.957 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -53.82 -38.24 64.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.88 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.523 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -75.08 -50.46 16.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.864 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.026 HD23 ' OD1' ' A' ' 83' ' ' ASN . 31.6 mt -52.17 -34.04 43.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER -34.78 -55.78 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.02 -2.41 21.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.837 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 1.026 ' OD1' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -90.72 -54.71 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.871 179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 30' ' ' VAL . 4.3 tp -75.76 95.31 3.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.768 ' O ' HG12 ' A' ' 85' ' ' VAL . 7.3 t -58.4 83.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.092 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 4' ' ' GLN . 51.8 p -102.55 147.97 26.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.11 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.666 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -110.96 151.72 27.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.913 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.666 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 82.93 144.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.176 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.867 0.365 . . . . 0.0 110.839 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 27.9 mm100 -38.73 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.906 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.4 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 76.01 141.68 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.856 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.683 HG23 ' N ' ' B' ' 119' ' ' PHE . 5.2 t -174.65 -152.09 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.161 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.683 ' N ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -48.78 -30.22 5.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.94 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . 0.514 ' H ' HG23 ' B' ' 118' ' ' THR . 0.5 OUTLIER -64.35 -30.93 71.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.863 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.45 ' C ' HD23 ' B' ' 122' ' ' LEU . 3.6 t0 -71.8 -40.75 68.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.832 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.793 HD23 ' N ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -92.35 -59.38 2.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.574 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 31.6 t-105 -38.21 -52.8 1.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' B' ' 123' ' ' TRP . 10.3 ptmm? -36.61 -40.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.868 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -37.59 -45.31 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.944 HD23 ' HE1' ' A' ' 31' ' ' MET . 0.1 OUTLIER -66.14 164.53 28.75 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.625 0.726 . . . . 0.0 110.878 179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 62.55 1.75 Allowed 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.637 2.224 . . . . 0.0 112.341 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.477 ' HA ' ' CG ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -65.61 -41.42 92.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.807 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.404 ' C ' ' O ' ' B' ' 128' ' ' GLU . 34.1 m-80 . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.925 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.853 HG22 HG21 ' A' ' 26' ' ' THR . 0.3 OUTLIER 54.52 106.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.13 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 27' ' ' VAL . 0.6 OUTLIER -125.21 119.85 29.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.64 141.96 56.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.908 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.786 HG21 ' CD1' ' A' ' 84' ' ' LEU . 5.5 m -135.26 172.14 16.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.91 83.78 12.47 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.719 . . . . 0.0 110.922 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.662 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.8 Cg_endo -69.8 137.99 36.64 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.712 2.275 . . . . 0.0 112.35 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.496 ' HB3' ' HD2' ' A' ' 10' ' ' PRO . 2.8 mtpt -82.61 -175.67 5.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.917 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.652 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -46.21 -50.72 36.92 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.589 0.709 . . . . 0.0 110.896 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 54.3 Cg_endo -69.7 -21.97 33.02 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.731 2.287 . . . . 0.0 112.366 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.637 ' O ' HD22 ' A' ' 15' ' ' LEU . 13.1 mt -93.32 -18.0 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.952 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.706 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.79 -40.66 47.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.943 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -23.82 66.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 12.0 mm -63.08 -57.0 13.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.133 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.669 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -71.92 -38.21 69.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.706 ' NE2' HD11 ' A' ' 12' ' ' LEU . 19.3 m170 -56.85 -45.23 82.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.876 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.31 -37.08 69.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.141 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.819 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -76.62 -14.59 59.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.115 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.38 -13.61 5.93 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.524 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -56.7 178.62 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.784 0.326 . . . . 0.0 111.089 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.79 119.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.907 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 147.35 -151.91 24.11 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.489 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 -38.91 1.58 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 110.877 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.55 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -110.51 152.33 26.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.869 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CG ' ' O ' ' A' ' 24' ' ' MET . 74.2 m-85 -162.1 154.93 20.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.906 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.853 HG21 HG22 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -96.47 161.22 14.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.462 ' N ' ' O ' ' A' ' 3' ' ' ASN . 4.0 p -47.9 -38.82 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.113 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.608 ' HD3' HD12 ' A' ' 2' ' ' ILE . 4.5 mtpt -62.18 -45.8 91.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.89 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.54 -54.08 41.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.894 HG11 ' CG ' ' A' ' 84' ' ' LEU . 35.6 t -52.58 -44.85 46.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.137 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.672 ' HE3' HD12 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -63.52 -40.37 96.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.88 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.407 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -67.57 -28.66 67.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 18.6 m-85 -74.81 -42.7 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.07 -55.89 13.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.934 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.06 -47.55 60.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.461 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.819 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -58.58 -45.69 88.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 0.0 110.938 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.08 -46.09 86.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.922 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.541 HD13 HG21 ' A' ' 52' ' ' VAL . 85.2 mt -59.34 -50.92 78.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.137 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.586 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -65.23 -24.64 67.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.447 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.5 OUTLIER -79.15 -37.9 19.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.12 179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.708 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -95.61 -1.7 49.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.92 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.479 ' NE2' ' O ' ' A' ' 39' ' ' MET . 17.6 mm-40 64.34 34.75 10.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.708 HD21 ' HB3' ' A' ' 41' ' ' LYS . 4.7 mt -87.68 37.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.586 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 17.8 p90 -140.6 168.48 19.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.903 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.547 ' OD1' ' CZ ' ' A' ' 53' ' ' TYR . 0.2 OUTLIER -94.0 124.56 38.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.858 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.64 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -67.49 -15.95 63.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.927 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.515 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.3 mp0 -81.6 -28.15 33.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -149.66 96.49 2.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.835 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -51.8 -20.67 2.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.922 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.608 ' HA ' HG22 ' A' ' 70' ' ' VAL . 29.2 p-80 -88.82 23.23 2.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 19.6 mmm -140.47 96.89 3.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG12 ' A' ' 70' ' ' VAL . 95.2 t -81.98 142.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.547 ' CZ ' ' OD1' ' A' ' 45' ' ' ASP . 3.2 m-85 -106.82 49.27 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.859 ' HA ' HD21 ' A' ' 59' ' ' LEU . 13.9 p -37.06 -45.49 0.6 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.887 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.452 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . -49.43 94.87 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.482 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 146.35 -13.83 1.63 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.448 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.455 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -129.32 172.15 11.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 110.862 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.468 ' H ' HD22 ' A' ' 58' ' ' LEU . 1.3 mm? -46.62 -51.36 15.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.926 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.875 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.4 OUTLIER -56.29 -36.52 68.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.875 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -66.08 -47.56 72.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.474 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' CG ' ' N ' ' A' ' 62' ' ' LEU . 3.5 pt-20 -61.15 -45.23 95.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.48 HD22 ' HA ' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -63.76 -41.22 98.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.894 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.52 -37.62 87.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 -2.88 83.07 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.479 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -109.45 158.7 17.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 110.859 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' GLY . 3.5 pt20 -83.02 -36.61 24.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 8.6 p -158.38 142.96 16.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.875 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.416 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 12.4 p90 -133.36 154.59 50.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.911 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.29 136.18 33.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.85 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.958 HG12 HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -76.16 -35.3 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.12 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.622 ' CE ' HD22 ' B' ' 122' ' ' LEU . 0.1 OUTLIER -72.92 -5.09 36.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.897 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -130.26 89.7 43.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.661 0.743 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.474 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.9 Cg_endo -69.82 62.72 1.82 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.69 2.26 . . . . 0.0 112.343 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.639 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.28 -70.01 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.624 0.726 . . . . 0.0 110.877 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.639 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.83 -28.13 25.31 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.708 2.272 . . . . 0.0 112.299 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.5 tp -56.88 -59.82 4.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.923 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' HH ' ' C ' ' B' ' 128' ' ' GLU . 18.2 m-85 -55.17 -33.42 62.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.932 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -60.84 -33.5 73.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.864 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.412 ' O ' ' HB2' ' A' ' 83' ' ' ASN . 22.1 ttp -79.8 -51.96 8.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 76' ' ' LEU . 6.1 mp -55.67 -31.53 62.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.965 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -39.88 -50.91 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -104.26 -2.87 25.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.917 179.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.528 ' O ' HD13 ' A' ' 11' ' ' LEU . 5.6 t30 -96.06 -59.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.894 ' CG ' HG11 ' A' ' 30' ' ' VAL . 1.3 mm? -87.53 116.36 25.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.903 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.691 ' O ' HG12 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -68.0 151.78 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.148 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.3 p -143.79 116.69 8.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.134 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.661 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -106.71 143.03 35.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.96 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.661 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 82.47 143.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 68.9 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.849 0.357 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.57 -166.93 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -175.34 -160.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.423 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 43.33 -152.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.567 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.67 -42.33 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.87 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.68 -43.55 47.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' B' ' 118' ' ' THR . 10.7 t0 -49.53 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.883 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.622 HD22 ' CE ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -77.99 -56.87 4.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.567 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 33.1 t-105 -34.79 -55.66 0.56 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.909 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 mttm -48.22 -44.78 33.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.886 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.7 OUTLIER -44.93 -25.72 0.34 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.93 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.672 HD12 ' HE3' ' A' ' 31' ' ' MET . 0.3 OUTLIER -40.69 137.76 1.35 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.565 0.698 . . . . 0.0 110.918 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.474 ' CD ' ' HG3' ' A' ' 73' ' ' PRO . 54.3 Cg_endo -69.74 -11.29 30.57 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.691 2.26 . . . . 0.0 112.38 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.421 ' O ' ' CG2' ' A' ' 27' ' ' VAL . 64.2 mt-10 63.94 -73.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.887 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' B' ' 127' ' ' PRO . 12.2 t30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.841 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 28' ' ' LYS . 4.9 mm 58.44 42.64 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.174 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.77 ' ND2' ' HB3' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -87.43 133.79 33.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.921 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.688 ' OE1' HG23 ' A' ' 26' ' ' THR . 34.1 mm-40 -67.45 160.6 27.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.896 HG12 HG22 ' A' ' 86' ' ' THR . 17.2 m -150.33 170.9 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -137.92 102.76 8.35 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.587 0.708 . . . . 0.0 110.84 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 103.81 1.23 Allowed 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.7 2.267 . . . . 0.0 112.321 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.464 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -54.28 -174.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.508 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.2 mt -53.62 -60.27 7.54 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.563 0.697 . . . . 0.0 110.904 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.77 -1.9 9.26 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.694 2.263 . . . . 0.0 112.334 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.762 ' O ' HD22 ' A' ' 15' ' ' LEU . 2.0 mt -112.8 -17.56 12.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.927 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.724 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -76.48 -42.07 44.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.951 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -63.51 -29.05 70.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.883 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.4 mt -59.9 -55.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.128 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.07 -38.02 72.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.94 179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.724 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.1 m170 -55.1 -46.16 75.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.847 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.65 -14.32 60.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.123 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.93 -4.85 35.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.117 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 118.99 -3.79 14.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.497 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.795 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -75.87 171.2 14.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 111.091 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -175.22 125.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.948 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' HD11 ' A' ' 12' ' ' LEU . . . 133.96 -149.45 19.74 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.493 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -144.36 14.54 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.907 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.57 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 13.6 mmt -150.0 136.7 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.655 ' O ' HG22 ' A' ' 5' ' ' VAL . 14.1 m-85 -162.1 158.75 25.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.873 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.688 HG23 ' OE1' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.35 -175.37 3.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.129 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 27' ' ' VAL . 1.5 t -61.37 -47.71 92.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.128 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -62.83 -39.37 94.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.837 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 8.4 mm-40 -63.92 -53.29 52.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.846 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.979 HG21 HD11 ' A' ' 84' ' ' LEU . 57.9 t -60.61 -35.72 65.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.14 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.526 ' HE1' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -73.16 -43.92 60.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.417 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -57.07 -31.31 65.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.795 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 31.0 m-85 -75.31 -33.78 61.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.935 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.45 -55.93 13.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.883 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.486 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.5 -47.66 62.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.499 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -61.22 -44.87 96.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.759 0.314 . . . . 0.0 110.896 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -56.91 -47.7 79.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.18 -48.05 90.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.132 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.543 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -64.66 -36.38 84.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.873 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.34 -38.59 81.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.157 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.6 mmmm -89.11 -11.46 43.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.698 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 65.05 49.6 2.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.944 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -105.82 51.73 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.936 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -160.35 167.99 26.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.922 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.34 113.31 20.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.879 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.539 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.4 OUTLIER -56.93 -30.38 63.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.881 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.6 OUTLIER -76.04 -27.82 57.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.14 86.4 2.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mp0 -53.92 -37.2 63.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.614 ' HA ' HG22 ' A' ' 70' ' ' VAL . 3.5 p-80 -60.89 -13.46 15.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.503 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 5.8 mmm -104.78 98.18 7.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.908 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.768 HG23 ' CG1' ' A' ' 70' ' ' VAL . 10.8 t -91.52 132.27 36.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.105 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' O ' HD23 ' A' ' 43' ' ' LEU . 32.1 m-85 -104.81 90.56 3.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.941 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.822 ' HA ' HD21 ' A' ' 59' ' ' LEU . 26.3 p -79.39 -46.99 16.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.913 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -46.54 93.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.49 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 148.37 -15.23 1.28 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.447 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' HB2' ' CD1' ' A' ' 43' ' ' LEU . 4.4 t0 -126.72 -179.8 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 mt -50.88 -53.56 31.46 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.921 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.834 HD23 ' H ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -55.37 -35.99 65.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.878 179.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.834 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -65.65 -50.43 54.28 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.539 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.03 -38.64 86.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.929 0.395 . . . . 0.0 110.888 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.436 ' N ' ' HG3' ' A' ' 61' ' ' GLU . 6.2 tp -71.82 -33.85 68.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.683 HD21 ' O ' ' A' ' 75' ' ' PRO . 1.2 mt -69.0 -40.76 78.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.95 -10.72 70.11 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.508 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.6 mmt180 -95.68 -154.22 0.43 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.764 0.316 . . . . 0.0 110.863 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.469 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -132.27 -40.97 1.0 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 71.2 p -157.92 134.74 9.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.841 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.677 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 5.3 p90 -134.64 162.14 33.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.855 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.485 ' OG ' ' CG ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER -105.91 136.24 45.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.768 ' CG1' HG23 ' A' ' 52' ' ' VAL . 0.8 OUTLIER -65.64 -32.59 58.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.112 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.546 ' HZ2' ' CD2' ' A' ' 50' ' ' HIS . 0.4 OUTLIER -70.75 -5.04 27.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.905 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.502 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -136.83 89.72 17.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.642 0.734 . . . . 0.0 110.851 179.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.635 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.78 66.38 1.79 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.692 2.262 . . . . 0.0 112.328 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.645 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.15 -70.47 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.666 0.746 . . . . 0.0 110.814 -179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.683 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.7 Cg_endo -69.73 -28.6 25.19 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 80' ' ' LEU . 5.6 tp -55.81 -60.69 3.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 14.8 m-85 -52.28 -38.89 59.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.23 -28.86 67.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.559 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.2 ttp -82.19 -41.31 20.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.853 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 84' ' ' LEU . 7.6 mp -63.68 -34.58 78.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.499 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 3.2 ptm180 -47.65 -48.26 28.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.54 -0.63 23.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 79' ' ' MET . 54.0 t-20 -103.48 -54.79 2.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.979 HD11 HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -65.01 95.59 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.761 ' O ' HG12 ' A' ' 85' ' ' VAL . 3.3 t -57.86 87.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.085 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.896 HG22 HG12 ' A' ' 5' ' ' VAL . 26.9 p -98.36 156.56 16.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.12 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.56 HD12 ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -146.06 -59.57 0.32 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.918 179.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.77 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . . . -37.86 95.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.051 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.449 ' N ' ' O ' ' A' ' 87' ' ' LEU . 2.7 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.147 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -152.33 93.44 1.8 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.913 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -120.21 133.59 55.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.88 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.436 HG22 ' N ' ' B' ' 119' ' ' PHE . 97.0 m -66.3 154.35 40.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.135 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.457 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -43.02 -55.54 3.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.857 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.42 -25.08 49.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' B' ' 121' ' ' ASP . 1.9 m-20 -73.18 -53.99 9.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.883 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB3' ' A' ' 50' ' ' HIS . 18.8 mt -83.74 -53.55 5.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.943 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.55 ' CZ3' ' CD2' ' B' ' 126' ' ' LEU . 23.1 t-105 -35.09 -56.24 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -40.26 -44.37 1.88 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' B' ' 122' ' ' LEU . 1.0 OUTLIER -58.0 -37.93 75.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.951 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.635 HD11 ' HB3' ' A' ' 73' ' ' PRO . 6.3 tp -46.67 104.71 0.42 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.614 0.721 . . . . 0.0 110.912 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.482 ' HD2' HD12 ' B' ' 126' ' ' LEU . 54.0 Cg_endo -69.68 155.61 65.75 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 0.0 112.343 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.495 ' OE1' ' CD1' ' A' ' 2' ' ' ILE . 0.5 OUTLIER -98.32 -30.78 12.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.866 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.922 -179.994 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.806 0.336 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.689 HG21 ' NZ ' ' A' ' 28' ' ' LYS . 9.0 mm -114.79 117.87 56.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.122 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.939 ' OD1' ' HB3' ' A' ' 88' ' ' ALA . 0.6 OUTLIER -109.59 178.2 4.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' C ' HG13 ' A' ' 5' ' ' VAL . 21.4 mm-40 -96.53 176.78 5.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.901 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.033 HG22 ' O ' ' A' ' 25' ' ' PHE . 4.2 m -156.95 172.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.636 ' H ' HG12 ' A' ' 85' ' ' VAL . 1.3 ttt85 -157.36 81.4 3.21 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 110.867 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.9 Cg_endo -69.72 117.35 5.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.679 2.252 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' LEU . 11.4 mttt -69.7 -164.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 8.1 mt -53.43 -60.09 7.82 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.595 0.712 . . . . 0.0 110.876 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.5 Cg_endo -69.76 -1.7 8.92 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.727 2.285 . . . . 0.0 112.34 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.71 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -112.38 -19.48 12.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.732 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.1 -40.17 46.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.922 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -65.74 -27.67 68.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.858 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 24.0 mm -60.7 -56.09 20.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.71 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.13 -39.37 72.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.732 ' NE2' HD22 ' A' ' 12' ' ' LEU . 17.9 m170 -54.94 -45.23 74.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.16 -31.81 71.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.112 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.928 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -79.68 -8.95 59.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.44 -6.24 10.73 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.487 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.765 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -65.52 179.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.793 0.33 . . . . 0.0 111.057 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 176.53 109.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.48 -147.59 17.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.431 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -136.74 -40.26 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.949 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.596 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -107.01 146.78 30.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 1.033 ' O ' HG22 ' A' ' 5' ' ' VAL . 64.6 m-85 -161.99 161.87 28.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.599 HG22 ' O ' ' A' ' 3' ' ' ASN . 0.7 OUTLIER -97.07 166.15 11.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.161 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 28' ' ' LYS . 4.5 p -52.39 -45.61 45.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.147 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.689 ' NZ ' HG21 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -66.33 -31.07 71.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.464 ' OE1' ' CE2' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.02 -51.49 18.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.927 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.025 HG11 HD11 ' A' ' 84' ' ' LEU . 94.5 t -60.41 -40.02 82.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.953 ' CE ' HD23 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.65 -35.11 76.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -61.47 -30.76 70.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.857 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.765 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 34.5 m-85 -75.31 -31.1 60.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -50.2 -56.64 10.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.916 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.23 -47.75 60.75 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.466 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.928 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 5.2 mm100 -60.12 -40.72 90.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.911 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.54 -47.06 87.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.938 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 56.6 mt -60.51 -48.93 86.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.158 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.514 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -62.73 -33.66 75.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.88 -38.56 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.098 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.604 ' HB3' HD23 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -84.12 -15.77 46.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.924 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.636 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 68.17 66.53 0.34 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.927 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.636 HD22 ' C ' ' A' ' 42' ' ' GLN . 4.4 mm? -127.61 59.57 1.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -165.88 171.83 12.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.71 126.3 36.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.829 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.66 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -64.38 -10.32 23.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.898 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 0.3 OUTLIER -97.47 -27.49 14.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 95.0 mt-10 -142.51 81.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -51.9 -19.03 1.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.916 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.895 ' HB3' HD23 ' B' ' 122' ' ' LEU . 43.5 p-80 -86.48 21.34 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.453 ' HA ' ' HE3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -132.26 47.31 2.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.886 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.609 HG23 ' CG1' ' A' ' 70' ' ' VAL . 83.2 t -37.96 131.88 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 12.1 m-85 -112.8 66.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.447 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.5 OUTLIER -38.0 -40.99 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.94 -80.03 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.491 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -159.46 22.24 0.29 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.51 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.62 176.25 9.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.782 0.325 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 mt -46.69 -54.66 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.903 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 pp -57.09 -35.84 69.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.425 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.4 -48.21 65.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.462 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -63.25 -37.52 87.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.872 0.368 . . . . 0.0 110.887 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.77 HD21 ' CG ' ' A' ' 83' ' ' ASN . 19.7 tp -65.82 -53.35 41.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -58.24 -43.06 87.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.899 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.19 -12.08 65.39 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.498 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -102.62 170.94 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.869 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -82.06 -36.87 27.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.898 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 p -155.66 176.95 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.826 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HB2' ' CG ' ' A' ' 75' ' ' PRO . 37.8 p90 -172.29 153.83 3.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.842 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 136.23 33.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.69 ' O ' HD13 ' B' ' 126' ' ' LEU . 1.3 m -75.63 -36.55 34.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -67.16 -8.73 33.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.86 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -125.34 95.85 40.3 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.621 0.725 . . . . 0.0 110.814 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.527 ' HB3' HD11 ' B' ' 126' ' ' LEU . 53.1 Cg_endo -69.81 59.26 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.706 2.271 . . . . 0.0 112.315 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.638 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.49 -70.64 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.681 0.753 . . . . 0.0 110.85 -179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.638 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.3 Cg_endo -69.74 -27.68 26.28 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.729 2.286 . . . . 0.0 112.319 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.712 HD22 HD21 ' B' ' 126' ' ' LEU . 5.5 tp -58.01 -61.1 2.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.9 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -52.05 -39.32 59.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -28.58 66.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.832 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.604 ' SD ' HD12 ' A' ' 63' ' ' LEU . 2.3 ttp -81.76 -39.47 24.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.893 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.553 ' HG ' HD23 ' A' ' 84' ' ' LEU . 7.3 mp -65.49 -34.41 78.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.467 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -48.3 -46.75 36.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -106.69 -1.15 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.932 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.77 ' CG ' HD21 ' A' ' 62' ' ' LEU . 45.0 t30 -103.7 -55.59 2.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.894 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.025 HD11 HG11 ' A' ' 30' ' ' VAL . 1.7 mm? -79.01 139.72 38.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.937 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.712 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.3 OUTLIER -85.13 13.65 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.144 179.856 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 85' ' ' VAL . 0.8 OUTLIER -34.56 101.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 0.3 OUTLIER -107.0 105.92 16.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.91 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.939 ' HB3' ' OD1' ' A' ' 3' ' ' ASN . . . 161.96 71.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.086 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.9 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.142 -179.887 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.11 152.82 24.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.92 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -143.39 129.64 19.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.888 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB2' ' B' ' 121' ' ' ASP . 1.3 m -128.88 143.01 50.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.12 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.473 ' CE1' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -47.04 -59.07 3.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.868 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 1.8 m -54.83 -19.92 7.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.868 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.421 ' HB3' HD13 ' B' ' 122' ' ' LEU . 0.2 OUTLIER -80.48 -54.45 5.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.88 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.895 HD23 ' HB3' ' A' ' 50' ' ' HIS . 0.1 OUTLIER -82.63 -50.81 8.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.47 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 20.5 t-105 -34.73 -58.94 0.49 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.546 ' CD ' ' N ' ' B' ' 125' ' ' LEU . 0.0 OUTLIER -46.03 -43.36 14.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.915 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' B' ' 124' ' ' LYS . 11.9 tp -51.71 -41.54 61.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.908 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.953 HD23 ' CE ' ' A' ' 31' ' ' MET . 6.4 tp -46.12 104.57 0.41 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.638 0.732 . . . . 0.0 110.935 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.686 2.258 . . . . 0.0 112.337 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.62 -7.63 58.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 27.2 m120 . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.929 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 2' ' ' ILE . 13.4 mm-40 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.817 0.341 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 1' ' ' GLN . 1.3 mm -130.35 168.15 23.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.645 ' O ' HG12 ' A' ' 27' ' ' VAL . 0.4 OUTLIER 80.02 -166.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.441 ' NE2' ' OD1' ' A' ' 3' ' ' ASN . 2.2 mp0 -67.52 149.35 50.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.871 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.911 HG21 HG21 ' A' ' 30' ' ' VAL . 27.5 m -134.01 172.26 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.435 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -139.88 96.57 8.28 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.883 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.9 Cg_endo -69.73 170.74 15.84 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.338 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -160.26 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.486 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -65.28 -60.64 7.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.615 0.721 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.8 Cg_endo -69.75 -7.57 21.4 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.679 2.253 . . . . 0.0 112.341 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 tp -99.15 -20.78 16.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.4 tp -75.15 -53.52 8.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.72 -29.32 17.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.878 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -62.99 -54.36 34.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.124 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.581 HD11 HG13 ' A' ' 30' ' ' VAL . 24.6 mt -69.9 -35.73 74.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.934 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 20.3 m170 -58.92 -49.59 77.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.27 -34.15 73.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.156 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.63 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -70.44 -13.53 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 121.5 10.21 6.69 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.47 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.742 ' HB2' ' CZ ' ' A' ' 33' ' ' TYR . . . -88.79 -177.57 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.724 0.297 . . . . 0.0 111.134 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.82 110.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 154.63 -151.49 23.14 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.438 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.62 -39.69 1.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.916 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.548 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -108.0 146.54 32.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.857 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.782 ' O ' HG22 ' A' ' 5' ' ' VAL . 66.7 m-85 -162.4 156.99 21.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.948 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.04 159.41 14.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.131 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.768 HG11 ' HA ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -44.8 -55.09 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -51.82 -30.13 22.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.878 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.95 -58.36 3.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.865 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.083 HG11 HD21 ' A' ' 84' ' ' LEU . 17.8 t -52.69 -33.55 18.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.133 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.748 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -73.33 -44.02 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.861 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.0 t60 -56.01 -30.89 62.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.858 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.742 ' CZ ' ' HB2' ' A' ' 20' ' ' ALA . 25.4 m-85 -74.46 -34.35 63.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.899 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.63 -58.38 5.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.01 -47.44 66.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.456 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -58.8 -43.14 90.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.33 . . . . 0.0 110.885 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.672 ' OH ' HD23 ' A' ' 58' ' ' LEU . 74.1 t80 -60.74 -46.53 90.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.897 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 HG21 ' A' ' 52' ' ' VAL . 76.7 mt -59.6 -46.78 92.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.488 ' HE2' ' O ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -69.71 -25.01 63.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.891 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -73.6 -39.99 54.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.098 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.475 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 18.6 mmmt -91.81 -15.66 27.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.893 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.625 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 65.8 78.16 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.625 HD12 ' C ' ' A' ' 42' ' ' GLN . 7.3 mp -135.14 51.55 2.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.412 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 42.4 p90 -151.09 168.99 22.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -77.37 113.39 15.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.441 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -56.6 -17.8 9.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.949 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.5 mm-40 -86.68 -30.69 21.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.92 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' A' ' 50' ' ' HIS . 92.0 mt-10 -137.24 93.61 2.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.899 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -56.58 -17.13 7.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.944 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.733 ' HB3' HD13 ' B' ' 122' ' ' LEU . 23.8 p-80 -84.55 11.36 8.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.879 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.04 112.38 13.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.521 HG21 HD13 ' A' ' 38' ' ' ILE . 49.8 t -96.11 135.66 29.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -116.96 60.55 0.74 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.554 ' SG ' ' CE2' ' A' ' 68' ' ' PHE . 3.9 m -45.88 -35.86 4.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.866 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 62.24 -76.38 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.504 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -155.93 20.08 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.494 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.624 ' CG ' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -79.14 177.53 8.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.672 HD23 ' OH ' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -46.58 -55.94 6.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.877 -179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.531 HD21 HD22 ' A' ' 43' ' ' LEU . 1.9 pt? -60.4 -37.51 81.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.494 ' CA ' ' HB3' ' A' ' 54' ' ' CYS . . . -62.97 -55.03 28.98 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.471 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -57.93 -48.67 79.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.84 0.353 . . . . 0.0 110.898 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.579 HD21 ' ND2' ' A' ' 83' ' ' ASN . 4.2 tp -55.55 -53.31 57.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.77 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.2 OUTLIER -57.14 -38.76 73.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.896 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.08 -17.17 58.81 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.449 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 10.9 mmt85 -102.23 126.88 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.788 0.328 . . . . 0.0 110.859 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.51 -36.17 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.65 151.65 24.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.821 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE2' ' SG ' ' A' ' 54' ' ' CYS . 5.8 p90 -142.31 154.65 44.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.864 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 66.5 m -97.41 140.38 31.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.822 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.586 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -73.25 -34.14 43.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.125 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.848 ' CE ' HD22 ' B' ' 122' ' ' LEU . 8.6 ttmt -75.86 -0.48 21.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.897 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -126.7 88.2 54.89 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.596 0.713 . . . . 0.0 110.846 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.488 ' HG3' ' CG ' ' B' ' 127' ' ' PRO . 53.6 Cg_endo -69.79 54.43 1.19 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.679 2.253 . . . . 0.0 112.368 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.593 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.9 OUTLIER -96.66 -68.7 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.642 0.734 . . . . 0.0 110.829 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.593 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.78 -19.85 35.5 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.748 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.8 tp -67.85 -57.47 6.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.424 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 56.0 m-85 -67.52 -36.86 81.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.38 -35.1 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.77 ' HG3' HD22 ' A' ' 63' ' ' LEU . 12.5 tmm? -79.8 -39.35 31.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.712 HD22 HD23 ' A' ' 84' ' ' LEU . 94.2 mt -67.44 -32.06 72.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.512 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 1.2 ptm180 -46.46 -48.31 19.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.847 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.512 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -107.08 -0.49 22.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.923 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.579 ' ND2' HD21 ' A' ' 62' ' ' LEU . 45.9 t30 -105.65 -53.43 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.914 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.083 HD21 HG11 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -88.79 105.7 17.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.906 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 5' ' ' VAL . 1.9 t -50.57 141.58 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.7 p -141.85 118.77 11.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.161 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.761 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -100.87 -170.98 1.92 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 53.67 29.7 9.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.117 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.132 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.1 OUTLIER -99.36 20.09 14.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.498 ' CG ' ' N ' ' B' ' 118' ' ' THR . 1.0 OUTLIER 83.25 -173.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -179.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.498 ' N ' ' CG ' ' B' ' 117' ' ' GLU . 0.2 OUTLIER 46.4 -151.82 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.577 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.96 -41.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.874 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.44 -43.46 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.857 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -49.62 -65.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.893 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.848 HD22 ' CE ' ' A' ' 71' ' ' LYS . 2.4 mt -77.91 -56.5 4.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.905 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.607 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 30.3 t-105 -34.85 -55.84 0.57 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -44.71 41.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.674 ' O ' HD23 ' B' ' 125' ' ' LEU . 5.6 tt -51.03 -37.4 45.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.928 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.598 ' CD2' ' CE ' ' A' ' 31' ' ' MET . 2.5 tp -37.52 121.73 0.93 Allowed Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.637 0.732 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.488 ' CG ' ' HG3' ' A' ' 73' ' ' PRO . 53.4 Cg_endo -69.78 64.77 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.654 2.236 . . . . 0.0 112.318 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.23 -33.67 0.15 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.883 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.916 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.752 0.31 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.665 ' HA ' HG21 ' A' ' 27' ' ' VAL . 4.8 mm 64.38 90.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.095 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER -105.25 173.63 6.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -80.93 162.72 23.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 30' ' ' VAL . 28.3 m -145.74 172.04 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 4.4 ttp85 -136.47 104.19 9.34 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.585 0.707 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.8 Cg_endo -69.75 112.45 3.08 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.662 2.242 . . . . 0.0 112.387 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 11' ' ' LEU . 16.6 mmtt -66.65 169.98 7.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.522 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -36.61 -58.9 0.96 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.593 0.711 . . . . 0.0 110.923 179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.81 -20.17 34.94 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.686 2.258 . . . . 0.0 112.334 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' A' ' 8' ' ' LYS . 0.2 OUTLIER -90.44 -15.25 31.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.924 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.48 -48.63 16.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -26.81 62.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 18.0 mm -63.75 -54.57 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.146 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.712 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -70.63 -36.93 73.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.921 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' CD2' HD22 ' A' ' 12' ' ' LEU . 6.2 m170 -58.42 -49.45 77.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.93 -43.16 69.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.831 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -67.74 -8.06 32.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.07 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.24 -0.9 22.44 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.502 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -73.14 175.19 6.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 111.107 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -172.22 129.62 0.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.563 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 133.44 -155.05 21.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.48 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -144.36 14.76 1.63 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.865 0.365 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.603 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 12.0 mmt -147.48 134.66 20.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.836 ' O ' HG22 ' A' ' 5' ' ' VAL . 30.3 m-85 -161.92 154.37 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -92.7 -175.51 3.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.113 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.665 HG21 ' HA ' ' A' ' 2' ' ' ILE . 2.0 t -62.46 -49.47 83.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.447 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -30.25 71.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.447 ' N ' ' CD ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -75.27 -48.47 23.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.862 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.996 HG21 HG21 ' A' ' 5' ' ' VAL . 36.6 t -61.36 -41.18 88.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.7 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -67.42 -42.74 82.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.415 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.66 -31.87 64.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.835 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 25.9 m-85 -74.5 -33.7 62.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -53.01 -55.67 21.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.948 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.506 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.75 -48.19 62.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.448 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.831 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.2 mm100 -62.09 -44.37 96.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.8 0.333 . . . . 0.0 110.901 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.6 -52.68 61.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.943 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.504 ' CG2' ' HB3' ' A' ' 44' ' ' TYR . 72.1 mt -58.68 -53.27 49.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.611 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -56.99 -40.56 76.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.875 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' A' ' 41' ' ' LYS . 0.4 OUTLIER -73.36 -32.05 35.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.128 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.609 ' O ' ' NE2' ' A' ' 42' ' ' GLN . 0.0 OUTLIER -82.1 -16.24 50.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.914 179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.609 ' NE2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 74.5 1.8 3.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.955 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -71.82 56.38 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.611 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.3 OUTLIER -172.87 168.3 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.45 ' OD2' ' N ' ' A' ' 48' ' ' GLU . 5.1 t0 -79.38 125.15 29.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.861 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.594 ' OE1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -70.0 -22.83 63.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.891 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.5 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 6.3 mm-40 -84.28 -23.13 30.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.949 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' N ' ' OD2' ' A' ' 45' ' ' ASP . 5.5 mm-40 -137.56 94.01 2.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.884 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -64.19 -21.4 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.882 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.684 ' HA ' HG22 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -77.11 -5.99 51.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.862 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.542 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 16.7 mmm -113.24 113.24 25.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.875 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.574 ' HB ' ' CE1' ' A' ' 68' ' ' PHE . 53.1 t -109.56 130.93 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.147 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.2 m-85 -103.39 57.27 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.911 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 1.9 p -43.0 -55.4 3.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -37.81 95.09 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.435 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . 151.26 -29.08 0.98 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.531 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.495 ' HB3' ' CD2' ' A' ' 59' ' ' LEU . 0.4 OUTLIER -120.54 -174.58 2.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.796 0.331 . . . . 0.0 110.896 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.74 HD13 ' OE2' ' A' ' 61' ' ' GLU . 0.3 OUTLIER -48.6 -47.83 39.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.949 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' H ' ' A' ' 59' ' ' LEU . 2.5 pt? -56.86 -38.91 73.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.924 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.96 -46.97 78.16 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.512 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.74 ' OE2' HD13 ' A' ' 58' ' ' LEU . 2.4 pt-20 -64.2 -46.94 81.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.885 0.374 . . . . 0.0 110.904 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' N ' ' CG ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -58.26 -50.96 71.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.933 -179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -64.39 -33.18 75.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.907 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.37 -11.84 60.11 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.483 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -86.72 -154.17 0.22 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 0.0 110.836 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 55' ' ' GLY . 2.4 mm-40 -130.38 -40.18 1.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.935 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.0 p -157.46 145.19 18.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.852 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.574 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 4.8 p90 -143.7 152.09 40.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.44 ' HB3' ' CD2' ' A' ' 50' ' ' HIS . 1.4 m -96.83 135.93 38.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.836 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.684 HG22 ' HA ' ' A' ' 50' ' ' HIS . 0.8 OUTLIER -72.16 -30.45 35.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.151 179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.544 ' NZ ' HD22 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -69.07 -7.37 35.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.896 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 54.4 t0 -132.25 93.55 25.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.56 0.695 . . . . 0.0 110.809 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 54.1 Cg_endo -69.79 59.1 1.62 Allowed 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 0.0 112.385 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.622 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.0 OUTLIER -97.06 -69.55 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.654 0.74 . . . . 0.0 110.841 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.622 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.74 -20.64 34.66 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.719 2.279 . . . . 0.0 112.345 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.7 HD21 ' CE ' ' A' ' 31' ' ' MET . 14.4 tp -65.52 -56.99 9.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -61.24 -37.08 81.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.919 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.72 -40.69 76.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.862 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.437 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 5.1 ttp -74.99 -50.43 16.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.867 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.902 HD22 HD13 ' A' ' 84' ' ' LEU . 57.6 mt -54.78 -31.64 59.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.908 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.478 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.61 -50.66 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.478 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -105.59 -1.65 24.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.9 179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.869 ' ND2' HD23 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -98.13 -56.37 2.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.902 HD13 HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -60.81 95.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.896 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.695 ' O ' HG12 ' A' ' 5' ' ' VAL . 2.9 t -49.46 130.46 7.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.132 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.8 p -124.4 124.56 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 88' ' ' ALA . 0.5 OUTLIER -114.73 71.72 0.77 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.973 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.453 ' HB2' ' O ' ' A' ' 87' ' ' LEU . . . 176.48 177.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.085 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.113 -179.873 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.841 0.353 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.439 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER -122.16 -65.04 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.871 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.439 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 0.0 OUTLIER 164.67 157.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.439 HG22 ' H ' ' B' ' 119' ' ' PHE . 0.2 OUTLIER 37.83 -152.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.168 -179.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.591 ' CD1' ' HB2' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -37.72 -42.2 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.908 -180.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.99 -43.43 40.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -49.77 -65.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.544 HD13 ' HB3' ' A' ' 50' ' ' HIS . 6.7 mt -77.57 -56.33 4.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.895 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.591 ' HB2' ' CD1' ' B' ' 119' ' ' PHE . 34.2 t-105 -34.51 -56.6 0.53 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.92 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.87 -44.02 66.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.1 OUTLIER -38.3 -41.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.681 HD11 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -82.64 136.74 44.91 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.636 0.731 . . . . 0.0 110.876 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.443 ' O ' HD12 ' B' ' 126' ' ' LEU . 53.7 Cg_endo -69.77 -165.57 0.16 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 0.0 112.361 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.53 -39.94 1.27 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.867 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.401 ' HB3' ' CD1' ' A' ' 2' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.849 ' O ' HG11 ' A' ' 27' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.749 ' O ' HG22 ' A' ' 2' ' ' ILE . 35.2 mm -142.05 37.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.099 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 27' ' ' VAL . 19.6 m120 -123.67 -174.77 3.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -67.14 135.5 53.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.019 HG11 ' CD1' ' A' ' 84' ' ' LEU . 17.9 m -125.47 145.99 31.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.125 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -108.39 116.94 55.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.604 0.716 . . . . 0.0 110.917 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 25' ' ' PHE . 53.4 Cg_endo -69.77 107.83 1.95 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.655 2.237 . . . . 0.0 112.376 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 12' ' ' LEU . 2.7 mttp -60.95 158.04 14.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -35.67 -59.33 0.75 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.574 0.702 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.523 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 53.6 Cg_endo -69.8 -23.5 30.53 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.639 2.226 . . . . 0.0 112.345 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.737 ' O ' HD22 ' A' ' 15' ' ' LEU . 22.2 mt -88.13 -11.6 46.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.683 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.1 tp -76.97 -42.0 40.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.945 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.523 ' CD ' ' HA ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -64.69 -26.75 68.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.555 ' CD1' HD13 ' A' ' 58' ' ' LEU . 23.6 mm -61.16 -56.06 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.737 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.44 -39.67 70.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.917 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.683 ' NE2' HD11 ' A' ' 12' ' ' LEU . 18.4 m170 -55.38 -44.06 75.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -18.61 63.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.97 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -97.45 1.1 48.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 116.9 -16.67 13.38 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.526 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -57.27 177.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.771 0.32 . . . . 0.0 111.049 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.445 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 173.82 118.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.938 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.99 -153.39 24.25 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -144.32 14.6 1.63 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.855 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.597 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -144.93 129.47 18.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.921 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.705 ' O ' HG22 ' A' ' 5' ' ' VAL . 23.8 m-85 -162.32 143.8 10.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.48 168.82 13.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.132 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.849 HG11 ' O ' ' A' ' 1' ' ' GLN . 2.4 t -47.69 -43.99 10.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.31 -44.62 78.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.75 -50.87 70.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.58 HG21 HG21 ' A' ' 5' ' ' VAL . 43.1 t -62.87 -50.74 78.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.167 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.736 ' HE2' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -58.25 -30.63 66.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.902 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -69.1 -29.92 68.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.838 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 31.5 m-85 -75.38 -31.07 60.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.29 -53.11 30.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.888 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.43 -47.86 61.64 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.502 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.97 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 2.6 mm100 -60.68 -39.94 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.86 -46.32 89.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.514 HD13 HG21 ' A' ' 52' ' ' VAL . 53.9 mt -61.63 -48.28 89.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -33.2 75.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.87 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -39.02 72.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.116 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.662 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.8 mmpt? -83.9 -16.17 45.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.895 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.52 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 66.58 67.53 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.909 179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.662 HD12 ' HB3' ' A' ' 41' ' ' LYS . 0.9 OUTLIER -134.72 64.03 1.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.933 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 p90 -156.04 169.4 24.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.901 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -93.89 103.07 15.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.582 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.4 mp0 -48.19 -24.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.91 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 47' ' ' GLN . 1.6 mp0 -79.99 -31.1 39.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -137.16 84.26 2.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB3' HD11 ' B' ' 122' ' ' LEU . 9.4 mp0 -48.72 -22.75 0.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.642 ' HA ' HG22 ' A' ' 70' ' ' VAL . 26.1 p-80 -89.22 28.14 1.28 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.828 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 16.7 mmm -145.3 81.18 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.71 HG23 HG12 ' A' ' 70' ' ' VAL . 76.1 t -69.07 141.4 17.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.155 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.4 ' O ' ' C ' ' A' ' 54' ' ' CYS . 3.4 m-85 -110.96 70.71 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.449 ' O ' ' N ' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -38.31 -41.68 0.64 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.873 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.428 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 57.62 -82.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.46 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -162.05 23.65 0.22 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.597 ' CG ' HD11 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -88.31 -178.58 5.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.865 0.364 . . . . 0.0 110.898 -179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.555 HD13 ' CD1' ' A' ' 14' ' ' ILE . 0.8 OUTLIER -46.51 -49.56 18.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.868 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.62 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.7 pt? -57.32 -40.67 78.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.938 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.438 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -62.94 -53.45 40.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.7 pt-20 -55.22 -45.13 75.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.923 0.392 . . . . 0.0 110.908 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.582 HD12 ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -58.98 -62.16 2.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.905 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.62 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -54.34 -44.05 71.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.958 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.66 23.59 35.74 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.47 -153.12 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.852 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -119.51 -38.48 3.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.902 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.5 p -157.17 146.19 20.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.899 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.62 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 18.6 p90 -144.25 146.71 32.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.1 136.35 33.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.832 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.902 HG21 HD12 ' B' ' 122' ' ' LEU . 1.0 OUTLIER -63.12 -36.07 74.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.133 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.427 ' HE2' ' CB ' ' B' ' 122' ' ' LEU . 0.0 OUTLIER -79.76 0.05 32.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.939 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.55 ' O ' ' HD2' ' A' ' 75' ' ' PRO . 3.1 m-20 -111.17 100.04 45.61 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.604 0.716 . . . . 0.0 110.834 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.494 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.1 Cg_endo -69.69 -1.08 7.81 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.252 . . . . 0.0 112.373 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.52 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.4 t -64.96 -63.66 3.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.694 0.759 . . . . 0.0 110.888 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.62 ' O ' HD21 ' A' ' 63' ' ' LEU . 54.0 Cg_endo -69.73 -18.13 37.33 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.708 2.272 . . . . 0.0 112.383 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.736 HD21 ' HE2' ' A' ' 31' ' ' MET . 15.7 tp -73.76 -59.24 2.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.0 m-85 -51.92 -29.26 19.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.927 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -58.7 -45.44 89.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.507 ' SD ' HD12 ' A' ' 63' ' ' LEU . 29.8 ttp -74.52 -52.45 11.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.883 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.875 ' HG ' HD23 ' A' ' 84' ' ' LEU . 3.4 mp -57.29 -29.12 63.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.913 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.486 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -43.91 -50.27 8.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.838 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.582 ' HD3' HD12 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.1 -1.87 26.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.929 179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.501 ' O ' ' CD1' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -98.54 -57.71 2.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.019 ' CD1' HG11 ' A' ' 5' ' ' VAL . 0.9 OUTLIER -60.82 118.65 6.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.73 ' O ' HG12 ' A' ' 5' ' ' VAL . 10.8 t -83.31 149.08 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 19.0 p -128.55 120.51 26.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.154 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.9 38.94 2.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -142.09 169.47 17.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.12 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.147 -179.9 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.485 ' O ' ' CB ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER 69.71 122.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.918 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.485 ' CB ' ' O ' ' B' ' 116' ' ' GLN . 1.0 OUTLIER 160.84 -85.9 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.874 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.573 HG22 ' N ' ' B' ' 119' ' ' PHE . 26.5 m -76.77 164.5 25.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.128 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.573 ' N ' HG22 ' B' ' 118' ' ' THR . 0.1 OUTLIER -44.46 -51.53 8.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -25.54 59.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.844 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' B' ' 121' ' ' ASP . 0.6 OUTLIER -73.71 -53.69 9.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.849 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.902 HD12 HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -83.33 -53.57 5.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.642 ' O ' HD23 ' B' ' 126' ' ' LEU . 26.4 t-105 -36.38 -57.96 0.72 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -36.88 70.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.895 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -60.82 -13.68 16.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.938 179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.642 HD23 ' O ' ' B' ' 123' ' ' TRP . 0.5 OUTLIER -34.85 97.51 0.12 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.628 0.727 . . . . 0.0 110.977 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.7 Cg_endo -69.73 -2.42 10.13 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.73 2.287 . . . . 0.0 112.324 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.403 ' O ' ' OH ' ' A' ' 77' ' ' TYR . 5.0 mm-40 63.27 -75.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.896 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' B' ' 127' ' ' PRO . 1.6 t-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.499 ' O ' HG13 ' A' ' 2' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.768 0.318 . . . . 0.0 110.936 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.789 HG21 ' CD ' ' A' ' 28' ' ' LYS . 0.8 OUTLIER 38.26 -162.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.674 ' N ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER 170.7 -174.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.869 179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.627 ' OE1' HG23 ' A' ' 26' ' ' THR . 16.8 mm-40 -101.04 171.92 7.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.941 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.992 HG22 ' O ' ' A' ' 25' ' ' PHE . 17.7 m -159.93 172.24 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.473 ' CB ' HG11 ' A' ' 85' ' ' VAL . 2.6 ttt-85 -140.36 98.28 7.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.574 0.702 . . . . 0.0 110.845 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 53.5 Cg_endo -69.77 110.75 2.63 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.7 2.267 . . . . 0.0 112.323 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.46 ' O ' ' N ' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -70.33 -177.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.863 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.533 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.51 -59.28 4.1 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.566 0.698 . . . . 0.0 110.907 179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.9 Cg_endo -69.72 -2.5 10.25 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.728 2.286 . . . . 0.0 112.328 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' A' ' 8' ' ' LYS . 4.6 mp -111.99 -17.0 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.944 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.509 HD11 ' NE2' ' A' ' 16' ' ' HIS . 2.2 tp -77.28 -49.29 15.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.949 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -32.39 63.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.899 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.3 mt -58.51 -55.04 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.769 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 10.2 mt -71.05 -39.49 72.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.509 ' NE2' HD11 ' A' ' 12' ' ' LEU . 5.3 m170 -59.15 -49.79 76.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.99 -28.98 70.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.994 ' HB1' ' CG ' ' A' ' 36' ' ' GLN . . . -83.33 -3.19 57.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 105.59 29.37 5.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.51 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.769 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -109.63 177.28 4.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.761 0.315 . . . . 0.0 111.082 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -173.46 118.94 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.851 -179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.62 179.18 17.89 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.491 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -120.4 6.76 10.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 110.884 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.606 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -138.23 131.65 30.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.896 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.992 ' O ' HG22 ' A' ' 5' ' ' VAL . 24.0 m-85 -158.05 145.22 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 1.033 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -82.9 177.56 8.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.178 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.674 HG23 ' N ' ' A' ' 3' ' ' ASN . 57.4 t -58.16 -39.1 71.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.161 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.789 ' CD ' HG21 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -70.66 -45.49 65.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 10.2 mm-40 -61.58 -39.12 90.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.058 HG11 ' CD2' ' A' ' 84' ' ' LEU . 14.4 t -68.91 -48.56 69.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.096 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.82 ' CE ' HD13 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -64.82 -44.28 90.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.812 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -50.76 -36.62 37.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.892 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.573 ' CD2' ' O ' ' A' ' 29' ' ' GLU . 30.4 m-85 -74.86 -35.72 62.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.907 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.518 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.4 OUTLIER -50.69 -56.34 12.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.944 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -52.71 -49.08 54.98 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.467 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.994 ' CG ' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -60.74 -37.62 82.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.895 -179.829 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' N ' ' HG3' ' A' ' 36' ' ' GLN . 74.3 t80 -63.62 -44.69 93.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 52' ' ' VAL . 62.0 mt -61.25 -45.13 99.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.133 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -69.66 -30.03 67.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.871 179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -71.5 -39.08 70.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.089 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.461 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.79 -16.6 33.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.907 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.4 59.38 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 19.4 mt -128.06 61.65 1.44 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.579 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 5.3 p90 -157.37 -176.5 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.917 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 47' ' ' GLN . 8.7 t0 -105.03 107.12 17.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.571 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.6 mp0 -55.88 -37.92 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.489 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.4 mm-40 -64.71 -30.11 71.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -143.04 94.0 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -53.32 -19.5 3.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 1.127 ' CE1' HD21 ' B' ' 122' ' ' LEU . 14.0 m80 -77.56 3.43 13.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.34 125.88 45.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.589 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 8.3 t -111.4 150.94 13.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.129 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -124.84 69.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.895 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.74 ' HA ' HD21 ' A' ' 59' ' ' LEU . 15.4 p -56.17 -31.07 63.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.886 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 53.22 -109.12 0.91 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.521 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -128.44 18.68 5.73 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.549 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.08 179.98 4.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.817 0.341 . . . . 0.0 110.865 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.412 ' H ' ' CD2' ' A' ' 58' ' ' LEU . 3.7 mm? -46.63 -54.51 9.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 60' ' ' GLY . 1.2 pt? -59.32 -40.76 87.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.744 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -58.63 -63.53 5.13 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.553 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.445 ' CD ' ' N ' ' A' ' 62' ' ' LEU . 2.1 pp20? -52.48 -48.56 65.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.878 0.371 . . . . 0.0 110.902 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.526 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -52.62 -45.46 66.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.876 -179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -68.65 -48.89 62.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.907 179.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.83 -7.83 38.91 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.522 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.476 ' CD ' ' N ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -105.12 -166.9 1.27 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.817 0.341 . . . . 0.0 110.855 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.409 ' C ' ' HG ' ' A' ' 54' ' ' CYS . 3.7 mp0 -108.79 -33.97 6.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.6 p -157.54 -176.1 5.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.837 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.589 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 22.0 p90 179.12 147.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m -93.06 139.1 30.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.843 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 50' ' ' HIS . 1.2 m -76.31 -6.97 9.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.627 ' HE2' ' CE1' ' A' ' 50' ' ' HIS . 6.6 ttmt -88.58 -21.91 23.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.871 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 22.3 m-20 -116.29 97.54 49.91 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.633 0.73 . . . . 0.0 110.825 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 53.4 Cg_endo -69.78 55.51 1.29 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.687 2.258 . . . . 0.0 112.337 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.62 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.61 -69.38 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.69 0.757 . . . . 0.0 110.843 -179.83 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.62 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.7 Cg_endo -69.77 -27.14 26.78 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.699 2.266 . . . . 0.0 112.314 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD21 ' CE ' ' A' ' 31' ' ' MET . 9.5 tp -59.39 -57.76 11.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.492 ' OH ' ' CB ' ' B' ' 128' ' ' GLU . 31.8 m-85 -62.66 -38.92 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.949 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 0.7 OUTLIER -53.46 -41.66 66.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.867 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.522 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 1.8 tmm? -74.75 -50.34 17.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.897 HD22 HD12 ' A' ' 84' ' ' LEU . 18.4 mt -54.81 -38.29 67.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.925 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 3.9 mtp85 -35.97 -57.65 0.68 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.44 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.51 -1.17 19.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.926 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.526 ' OD1' HD12 ' A' ' 62' ' ' LEU . 6.4 t30 -92.32 -50.13 5.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.872 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.058 ' CD2' HG11 ' A' ' 30' ' ' VAL . 1.3 mt -81.99 95.48 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' CB ' ' A' ' 6' ' ' ARG . 3.1 t -37.37 139.05 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.097 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 84' ' ' LEU . 14.1 p -138.68 138.54 37.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.594 ' O ' ' HB3' ' A' ' 88' ' ' ALA . 3.1 mp -121.42 -54.89 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 87' ' ' LEU . . . 76.93 105.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.106 -179.898 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.811 0.338 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.14 114.9 17.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.42 166.44 24.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.888 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.671 HG23 ' N ' ' B' ' 119' ' ' PHE . 4.9 t -173.24 -153.07 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.195 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.671 ' N ' HG23 ' B' ' 118' ' ' THR . 4.2 t80 -41.87 -27.76 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.891 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.02 -41.98 97.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -86.96 -34.42 19.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.863 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 1.127 HD21 ' CE1' ' A' ' 50' ' ' HIS . 15.1 tp -73.58 -53.93 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.848 ' CZ3' HD11 ' B' ' 126' ' ' LEU . 66.1 t-105 -37.64 -57.55 0.96 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -55.52 -35.41 65.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.909 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' B' ' 122' ' ' LEU . 0.2 OUTLIER -59.22 -14.32 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.917 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.848 HD11 ' CZ3' ' B' ' 123' ' ' TRP . 0.3 OUTLIER -35.35 113.51 0.49 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.6 0.714 . . . . 0.0 110.903 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.41 ' O ' ' C ' ' B' ' 128' ' ' GLU . 53.9 Cg_endo -69.76 64.67 1.81 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.711 2.274 . . . . 0.0 112.328 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.492 ' CB ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -37.8 -33.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.9 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.842 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.789 0.328 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.596 ' N ' HD13 ' A' ' 2' ' ' ILE . 2.6 mm 65.27 43.79 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.147 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.52 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -87.38 132.6 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.52 ' N ' HD22 ' A' ' 3' ' ' ASN . 2.0 mp0 -68.13 152.6 45.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 30' ' ' VAL . 29.7 m -139.13 171.95 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.156 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 7.3 ttt180 -134.32 108.18 11.26 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.636 0.731 . . . . 0.0 110.869 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 6' ' ' ARG . 54.1 Cg_endo -69.78 106.86 1.74 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.684 2.256 . . . . 0.0 112.342 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -58.04 -155.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.882 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.624 HD23 ' N ' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -72.76 -61.06 1.73 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.637 0.732 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' CD ' ' HG ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.74 -10.13 27.82 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.729 2.286 . . . . 0.0 112.334 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.631 HD11 ' O ' ' A' ' 83' ' ' ASN . 8.7 mt -95.46 -39.46 9.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.928 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.463 HD11 ' NE2' ' A' ' 16' ' ' HIS . 4.2 tp -58.72 -42.11 87.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.927 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -30.1 70.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 mm -59.84 -55.56 23.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.145 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.674 ' N ' HD13 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -70.09 -39.93 75.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.921 179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.463 ' NE2' HD11 ' A' ' 12' ' ' LEU . 6.0 m170 -53.68 -46.79 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.868 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.57 -43.24 75.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.085 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' HB2' ' A' ' 37' ' ' TYR . . . -68.64 -17.09 64.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.113 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 129.8 -10.52 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.794 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.03 177.81 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.748 0.308 . . . . 0.0 111.138 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.455 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 177.47 112.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.88 -179.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.08 -163.54 29.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -134.25 6.58 3.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.844 0.354 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.6 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -141.65 133.62 27.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.874 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.793 ' O ' HG22 ' A' ' 5' ' ' VAL . 27.1 m-85 -161.78 151.4 16.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.903 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.83 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.54 -175.42 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.134 -179.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.753 HG11 ' C ' ' B' ' 129' ' ' ASN . 0.6 OUTLIER -53.95 -53.26 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.127 179.891 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.512 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -60.78 -50.48 73.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 55.9 mm-40 -55.08 -37.3 66.61 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.856 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.019 HG21 HG21 ' A' ' 5' ' ' VAL . 67.6 t -73.44 -59.13 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.169 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.632 ' HE1' HD22 ' B' ' 126' ' ' LEU . 0.1 OUTLIER -53.24 -46.99 69.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.846 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -50.68 -33.54 23.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.835 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.794 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 17.0 m-85 -74.59 -39.58 62.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.931 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 31' ' ' MET . 0.4 OUTLIER -55.38 -58.01 9.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.904 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -50.63 -47.6 45.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.447 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.429 ' O ' ' HB ' ' A' ' 40' ' ' VAL . 0.1 OUTLIER -67.48 -35.13 78.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.773 0.32 . . . . 0.0 110.907 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 47.9 t80 -62.83 -41.96 99.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.914 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.439 HG21 HG13 ' A' ' 52' ' ' VAL . 8.1 mt -68.9 -44.2 81.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.094 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.602 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -66.46 -28.98 69.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -78.11 -39.84 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.161 179.926 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.462 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -83.93 -15.95 46.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.91 179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.33 45.18 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mt -112.79 61.89 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.602 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 10.3 p90 -160.98 177.13 10.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.89 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.473 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 8.7 t0 -89.87 99.47 12.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.863 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.559 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 1.9 mp0 -52.01 -35.26 46.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.48 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 7.5 mm-40 -66.93 -29.12 68.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.935 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.52 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 mt-10 -149.69 95.0 2.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.905 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.43 ' O ' HG11 ' A' ' 70' ' ' VAL . 14.3 mp0 -52.69 -19.66 2.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.947 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.533 ' CD2' ' C ' ' A' ' 50' ' ' HIS . 1.4 p-80 -68.71 -6.02 23.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.859 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.504 ' HE2' ' C ' ' A' ' 51' ' ' MET . 0.0 OUTLIER -124.08 100.6 6.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.879 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.647 HG23 HG12 ' A' ' 70' ' ' VAL . 21.0 t -83.35 158.24 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.153 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.509 ' N ' ' CG1' ' A' ' 52' ' ' VAL . 2.7 m-85 -127.17 128.96 46.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.881 ' HA ' HD21 ' A' ' 59' ' ' LEU . 0.7 OUTLIER -100.31 -40.98 7.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.865 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.439 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 59.19 -81.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.454 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -158.74 23.12 0.33 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.472 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.49 178.07 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.844 0.354 . . . . 0.0 110.856 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.92 -49.17 20.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.881 HD21 ' HA ' ' A' ' 54' ' ' CYS . 1.1 pt? -60.14 -37.42 80.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.732 ' H ' HD23 ' A' ' 59' ' ' LEU . . . -67.3 -43.65 87.86 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.485 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -68.54 -34.4 75.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.884 0.373 . . . . 0.0 110.916 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CD1' ' OD1' ' A' ' 83' ' ' ASN . 0.7 OUTLIER -72.61 -39.54 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.885 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.523 HD13 ' CD2' ' A' ' 68' ' ' PHE . 0.3 OUTLIER -82.91 -19.98 36.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.926 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.19 10.23 39.91 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -109.05 -171.26 1.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.758 0.314 . . . . 0.0 110.897 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.26 -46.62 4.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.9 p -157.15 141.2 16.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.603 ' CZ ' HG11 ' A' ' 52' ' ' VAL . 43.8 p90 -127.36 148.31 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.1 m -91.2 141.87 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.842 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.815 ' CG2' HD23 ' B' ' 122' ' ' LEU . 0.8 OUTLIER -77.87 -34.15 19.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.14 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.793 ' HD3' HD11 ' B' ' 122' ' ' LEU . 2.0 tppt? -68.9 -21.44 64.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.917 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -110.88 92.19 14.24 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 110.866 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 54.42 1.18 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.717 2.278 . . . . 0.0 112.356 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.627 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.79 -69.4 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.628 0.727 . . . . 0.0 110.844 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.627 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.0 Cg_endo -69.7 -27.35 26.86 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.68 2.254 . . . . 0.0 112.353 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' B' ' 126' ' ' LEU . 17.0 tp -59.62 -55.39 35.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -68.91 -43.05 75.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -55.17 -39.77 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.842 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.52 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -73.45 -50.17 23.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.881 -179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.747 ' CD2' HD23 ' A' ' 84' ' ' LEU . 80.8 mt -55.63 -39.0 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -35.7 -56.55 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.407 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.64 -1.43 19.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.875 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.631 ' O ' HD11 ' A' ' 11' ' ' LEU . 41.0 t30 -96.03 -50.04 5.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.849 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.809 HD21 ' CG1' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -89.7 105.8 18.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.915 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.61 ' O ' HG12 ' A' ' 5' ' ' VAL . 3.6 t -37.66 137.41 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.112 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 84' ' ' LEU . 16.6 p -136.17 120.73 18.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.162 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.3 mp -109.73 133.21 53.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 56.06 103.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.1 m . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.097 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . 0.435 ' N ' ' OE2' ' B' ' 117' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.837 0.351 . . . . 0.0 110.93 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.437 ' NE2' ' O ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -106.21 123.64 48.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.93 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.668 ' HG3' HD13 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -169.27 128.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.859 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 90.3 m -51.52 150.44 3.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.144 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.649 ' CE1' ' CE3' ' B' ' 123' ' ' TRP . 0.1 OUTLIER -45.38 -56.95 4.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.12 -20.97 2.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.864 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.66 -56.01 4.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.815 HD23 ' CG2' ' A' ' 70' ' ' VAL . 9.1 tp -83.17 -51.75 7.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.649 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 19.2 t-105 -36.08 -57.16 0.71 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.922 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -48.79 -40.95 30.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 16.1 tp -42.29 -47.91 4.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.904 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.737 HD11 ' O ' ' A' ' 70' ' ' VAL . 1.6 mp -58.82 109.78 2.13 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.602 0.715 . . . . 0.0 110.894 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.545 ' O ' ' N ' ' B' ' 129' ' ' ASN . 53.8 Cg_endo -69.75 62.09 1.75 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.655 2.237 . . . . 0.0 112.373 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' B' ' 127' ' ' PRO . 0.5 OUTLIER 34.37 -90.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.87 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.753 ' C ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.775 0.321 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.825 HG22 HG21 ' A' ' 26' ' ' THR . 0.4 OUTLIER 55.05 107.09 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.137 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.602 ' H ' HG12 ' A' ' 27' ' ' VAL . 0.7 OUTLIER -121.2 122.46 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.884 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -68.19 163.16 23.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.922 HG22 ' O ' ' A' ' 25' ' ' PHE . 16.0 m -150.27 172.38 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.138 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.708 ' O ' HG11 ' A' ' 85' ' ' VAL . 1.8 ttt85 -146.67 81.44 9.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.644 0.735 . . . . 0.0 110.874 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.524 ' HD3' HG23 ' A' ' 5' ' ' VAL . 53.6 Cg_endo -69.72 122.6 9.29 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 0.0 112.348 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.445 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.3 mmmt -77.52 -158.14 0.11 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.483 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 1.5 tp -59.19 -60.68 9.77 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.642 0.734 . . . . 0.0 110.931 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.3 Cg_endo -69.73 -7.88 22.18 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 0.0 112.332 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.694 HD22 HG23 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -105.06 -22.68 13.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.92 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.804 HD11 ' NE2' ' A' ' 16' ' ' HIS . 7.8 tp -76.88 -53.16 8.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.49 -28.77 21.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.905 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.3 mt -63.24 -54.36 34.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.096 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 3.4 mt -70.5 -35.6 73.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.804 ' NE2' HD11 ' A' ' 12' ' ' LEU . 27.6 m170 -59.33 -49.36 78.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.871 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.33 -15.4 15.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.075 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.937 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -96.99 18.42 14.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.119 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.13 -0.19 75.17 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.458 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.779 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -77.95 176.81 8.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 111.121 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.484 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER 177.36 114.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 157.48 -152.85 24.13 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.425 ' HB3' ' CE ' ' A' ' 24' ' ' MET . 86.6 mt-10 -128.4 -38.8 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.882 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.595 ' C ' ' CD1' ' A' ' 25' ' ' PHE . 6.3 mmt -116.8 155.78 28.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.912 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.922 ' O ' HG22 ' A' ' 5' ' ' VAL . 55.7 m-85 -161.88 156.89 23.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.888 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.825 HG21 HG22 ' A' ' 2' ' ' ILE . 0.6 OUTLIER -89.85 -175.24 4.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.103 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.602 HG12 ' H ' ' A' ' 3' ' ' ASN . 7.6 p -63.64 -53.04 49.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.19 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.791 ' NZ ' HG23 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -63.81 -27.46 69.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.916 179.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.528 ' N ' ' HD3' ' A' ' 28' ' ' LYS . 68.4 mm-40 -73.94 -42.02 61.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.911 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.893 HG11 ' CD1' ' A' ' 84' ' ' LEU . 94.1 t -71.11 -36.96 64.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.593 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.86 -44.02 67.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.911 179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.411 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.7 t60 -54.83 -33.81 62.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.779 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 24.8 m-85 -74.58 -33.81 62.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.44 -58.16 6.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.936 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.482 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.99 -47.76 65.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.443 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.937 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 1.1 mt-30 -60.83 -39.73 90.13 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.81 0.338 . . . . 0.0 110.871 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -61.88 -48.56 79.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.953 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 59' ' ' LEU . 61.6 mt -60.23 -47.63 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.171 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.434 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.56 -33.77 76.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.857 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.27 -38.86 75.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 42' ' ' GLN . 5.2 mmpt? -84.67 -15.39 45.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.908 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER 67.19 61.59 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.946 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.83 HD13 ' CD2' ' A' ' 59' ' ' LEU . 4.6 mt -122.51 63.24 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.3 p90 -175.33 170.46 3.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.888 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.37 118.78 23.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.789 ' N ' HE21 ' A' ' 46' ' ' GLN . 0.7 OUTLIER -61.09 -19.38 61.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.906 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.623 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.1 OUTLIER -87.54 -29.17 21.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.929 -179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.499 ' OE1' ' CG ' ' A' ' 51' ' ' MET . 33.1 tt0 -134.69 90.87 2.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.874 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' O ' HG11 ' A' ' 70' ' ' VAL . 21.9 mp0 -61.95 -22.69 65.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.633 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -69.33 -5.59 24.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.885 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.499 ' CG ' ' OE1' ' A' ' 48' ' ' GLU . 4.6 mmm -120.72 115.35 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.731 HG11 ' CZ ' ' A' ' 68' ' ' PHE . 81.0 t -97.65 137.46 25.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -119.28 82.56 1.89 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.601 ' HA ' HD21 ' A' ' 59' ' ' LEU . 18.5 p -55.98 -44.74 78.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.905 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 63.1 9.89 31.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.15 -16.3 20.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.508 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.458 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -49.27 179.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -46.46 -54.22 9.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.851 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -57.65 -33.56 68.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.455 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -67.73 -47.83 59.19 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.5 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.36 -39.95 95.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.911 0.386 . . . . 0.0 110.893 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.527 HD12 ' HB2' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -68.89 -39.64 79.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.892 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.7 HD22 ' HG3' ' A' ' 79' ' ' MET . 0.4 OUTLIER -71.36 -37.22 71.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.911 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.29 -14.45 63.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.485 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' N ' ' HD3' ' A' ' 65' ' ' ARG . 11.4 mmt85 -102.2 -166.8 1.32 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.889 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -105.52 -31.36 9.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 p -157.8 140.48 14.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.851 ' CZ ' HD12 ' A' ' 59' ' ' LEU . 44.8 p90 -134.46 145.77 49.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.837 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.56 138.19 31.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.856 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.748 ' O ' HD13 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -75.88 -29.36 19.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.172 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.456 ' HE2' ' CA ' ' A' ' 71' ' ' LYS . 1.8 tppt? -71.23 -20.29 62.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.885 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -114.37 93.62 32.42 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.609 0.719 . . . . 0.0 110.86 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 54.92 1.22 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.246 . . . . 0.0 112.37 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.604 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 1.0 OUTLIER -96.65 -69.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.675 0.75 . . . . 0.0 110.824 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.604 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 54.1 Cg_endo -69.73 -22.38 32.3 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.623 HD22 HD21 ' B' ' 126' ' ' LEU . 14.9 tp -64.85 -56.09 15.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' B' ' 129' ' ' ASN . 41.4 m-85 -66.49 -43.64 84.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.928 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -52.88 -36.51 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.881 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.7 ' HG3' HD22 ' A' ' 63' ' ' LEU . 7.8 tmm? -77.88 -50.45 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.822 HD23 HD22 ' A' ' 83' ' ' ASN . 77.4 mt -55.25 -34.03 63.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.932 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.48 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -42.67 -51.42 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.872 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.48 ' N ' ' CG ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -106.27 -1.32 23.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.873 179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.822 HD22 HD23 ' A' ' 80' ' ' LEU . 3.6 t30 -99.64 -55.4 2.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.893 ' CD1' HG11 ' A' ' 30' ' ' VAL . 2.0 tp -62.59 95.99 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.877 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.708 HG11 ' O ' ' A' ' 6' ' ' ARG . 73.3 t -47.25 91.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.105 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 84' ' ' LEU . 71.6 p -114.89 139.45 49.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.14 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 87' ' ' LEU . 0.5 OUTLIER -109.8 35.99 3.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.895 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -88.43 -171.1 3.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.097 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.155 -179.866 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.805 0.336 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 71.52 124.4 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.927 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.61 -156.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.956 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.576 HG22 ' N ' ' B' ' 119' ' ' PHE . 24.9 m -42.4 165.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.576 ' N ' HG22 ' B' ' 118' ' ' THR . 0.3 OUTLIER -48.27 -30.15 4.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.915 179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.16 -30.82 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.904 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.85 -39.0 76.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' B' ' 122' ' ' LEU . 0.0 OUTLIER -94.83 -59.33 1.94 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.63 ' CZ3' HD22 ' B' ' 126' ' ' LEU . 39.4 t-105 -35.31 -51.57 0.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.906 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -42.39 -45.84 4.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.935 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.58 -34.95 65.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.748 HD13 ' O ' ' A' ' 70' ' ' VAL . 11.1 tp -50.58 112.3 2.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.601 0.715 . . . . 0.0 110.92 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.665 ' HD2' HD12 ' B' ' 126' ' ' LEU . 53.8 Cg_endo -69.77 157.69 59.5 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -97.77 -36.39 10.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 77' ' ' TYR . 2.7 m120 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.867 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.82 0.343 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.85 ' HA ' HG11 ' A' ' 27' ' ' VAL . 1.5 pp -124.57 102.66 11.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.17 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -97.54 168.23 10.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.519 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 0.3 OUTLIER -84.94 176.87 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.94 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.026 HG21 ' CG2' ' A' ' 30' ' ' VAL . 17.2 m -150.04 172.17 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.121 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.549 ' CB ' HG11 ' A' ' 85' ' ' VAL . 19.4 ttt180 -149.47 86.83 5.38 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 0.0 110.903 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CB ' ' HB3' ' A' ' 11' ' ' LEU . 53.6 Cg_endo -69.8 115.39 4.07 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.656 2.237 . . . . 0.0 112.356 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 12' ' ' LEU . 44.4 mmtt -67.2 -176.86 0.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.893 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.537 ' H ' HD23 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -44.49 -58.99 4.38 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.609 0.719 . . . . 0.0 110.861 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.77 -2.73 10.67 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.66 2.24 . . . . 0.0 112.346 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.775 ' O ' HD22 ' A' ' 15' ' ' LEU . 3.3 mp -111.85 -17.43 12.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.769 HD22 ' NE2' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -77.7 -43.35 31.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.931 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.42 -30.97 71.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.405 ' N ' ' HG3' ' A' ' 13' ' ' LYS . 3.2 mt -57.98 -56.1 17.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.169 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.775 HD22 ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -71.06 -38.42 72.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.945 179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.769 ' NE2' HD22 ' A' ' 12' ' ' LEU . 18.7 m170 -54.21 -44.54 71.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.835 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.01 -29.01 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.094 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -84.84 3.38 38.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.11 -18.15 21.55 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.463 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -58.05 172.87 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.75 0.31 . . . . 0.0 111.084 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' HA ' ' CD2' ' A' ' 16' ' ' HIS . 2.9 tp-100 178.59 121.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.91 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 145.78 -146.32 16.34 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -146.06 15.71 1.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.885 0.374 . . . . 0.0 110.9 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.554 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -162.05 144.37 11.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.887 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.973 ' O ' HG22 ' A' ' 5' ' ' VAL . 35.1 m-85 -161.9 160.33 27.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.71 173.91 7.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.116 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.85 HG11 ' HA ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -50.81 -53.99 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.132 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.425 ' CD ' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -58.12 -44.0 87.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.919 179.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.53 -51.85 67.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.845 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.026 ' CG2' HG21 ' A' ' 5' ' ' VAL . 98.1 t -57.38 -51.53 68.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.133 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.775 ' CE ' HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -60.96 -41.02 95.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.856 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.414 ' N ' ' HG3' ' A' ' 31' ' ' MET . 2.2 t60 -56.23 -33.29 65.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.851 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 30.6 m-85 -75.2 -34.77 61.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.856 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' HG ' HD11 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -50.32 -54.15 23.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.562 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -54.08 -48.57 62.61 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.468 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.952 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 11.6 mm100 -62.25 -41.12 98.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.11 -52.43 65.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.961 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.441 HG23 ' O ' ' A' ' 43' ' ' LEU . 47.2 mt -58.96 -47.11 90.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.597 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -63.55 -38.83 92.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.834 179.897 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -70.9 -39.39 75.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.116 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -79.15 -15.98 57.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.891 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.55 47.17 0.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.944 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 59' ' ' LEU . 2.5 mt -116.26 68.94 0.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.962 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.597 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 0.9 OUTLIER -178.79 162.76 1.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.965 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -77.36 119.58 21.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.879 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.522 ' OE1' ' CZ ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -63.65 -30.02 71.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.9 OUTLIER -80.44 -31.67 37.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -128.83 76.86 1.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.583 ' O ' HG11 ' A' ' 70' ' ' VAL . 22.0 mp0 -52.59 -20.16 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.921 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.5 ' CD2' ' HG2' ' A' ' 51' ' ' MET . 2.1 p-80 -68.24 -6.08 21.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.856 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 50' ' ' HIS . 4.6 mmm -127.95 124.01 36.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.881 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.849 HG11 ' CD1' ' A' ' 68' ' ' PHE . 0.5 OUTLIER -99.12 152.64 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.134 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' A' ' 67' ' ' SER . 19.4 m-85 -127.86 69.97 1.33 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.686 ' CB ' HD11 ' A' ' 59' ' ' LEU . 1.8 p -88.8 20.59 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.856 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . -60.94 84.44 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.478 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.37 19.4 3.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.454 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.5 ' OD1' HD21 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -118.28 160.5 21.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.795 0.331 . . . . 0.0 110.855 -179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.462 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER -46.59 -52.7 13.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.926 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.686 HD11 ' CB ' ' A' ' 54' ' ' CYS . 0.5 OUTLIER -54.87 -36.18 64.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' CA ' ' SG ' ' A' ' 54' ' ' CYS . . . -66.67 -53.84 25.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.482 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 7.1 pt-20 -54.75 -44.2 73.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.867 0.365 . . . . 0.0 110.896 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.495 HD12 ' OD1' ' A' ' 83' ' ' ASN . 0.2 OUTLIER -64.32 -43.37 94.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.906 -179.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.484 ' HG ' ' CG ' ' A' ' 79' ' ' MET . 0.2 OUTLIER -71.44 -19.59 62.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.939 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.3 -11.63 60.46 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.461 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -104.35 -150.97 0.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.758 0.313 . . . . 0.0 110.877 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -140.34 -40.35 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.905 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.456 ' HB2' ' HA ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -143.99 144.13 31.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.828 -179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.849 ' CD1' HG11 ' A' ' 52' ' ' VAL . 1.7 p90 -138.63 -176.64 4.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.6 134.8 54.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.706 ' O ' HD11 ' B' ' 126' ' ' LEU . 0.7 OUTLIER -74.08 -42.01 52.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.103 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.847 ' HE2' HD22 ' B' ' 122' ' ' LEU . 9.9 ttmt -71.85 -7.9 51.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.863 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -128.16 84.54 62.96 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.602 0.715 . . . . 0.0 110.834 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 53.9 Cg_endo -69.72 68.68 1.66 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.674 2.25 . . . . 0.0 112.355 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.634 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -96.51 -69.85 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.701 0.762 . . . . 0.0 110.895 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.634 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.9 Cg_endo -69.7 -27.31 26.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.674 2.249 . . . . 0.0 112.371 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.775 HD21 ' CE ' ' A' ' 31' ' ' MET . 13.0 tp -56.88 -53.9 52.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 27.8 m-85 -65.42 -45.77 82.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -51.92 -39.39 59.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.861 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -73.22 -50.45 22.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.997 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.94 ' CD2' HD23 ' A' ' 84' ' ' LEU . 55.1 mt -55.4 -39.09 69.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -35.84 -56.64 0.7 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.9 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.403 ' HD2' ' N ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -108.63 -1.31 19.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.89 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 79' ' ' MET . 44.4 t30 -95.93 -50.11 5.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.851 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.94 HD23 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -91.46 106.76 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.549 HG11 ' CB ' ' A' ' 6' ' ' ARG . 0.9 OUTLIER -41.58 145.49 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.524 ' C ' HD23 ' A' ' 87' ' ' LEU . 17.8 p -140.08 135.45 32.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.524 HD23 ' C ' ' A' ' 86' ' ' THR . 0.1 OUTLIER -115.25 155.81 26.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.938 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . 58.04 88.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.117 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 -179.841 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.794 0.33 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -163.39 146.21 10.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 70.6 151.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.923 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.736 HG23 ' N ' ' B' ' 119' ' ' PHE . 0.6 OUTLIER -172.54 -173.43 1.03 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.736 ' N ' HG23 ' B' ' 118' ' ' THR . 0.1 OUTLIER -45.01 -48.3 11.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . 0.532 ' H ' HG23 ' B' ' 118' ' ' THR . 0.3 OUTLIER -57.42 -25.33 59.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.865 -179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -85.53 -47.75 9.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.908 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.847 HD22 ' HE2' ' A' ' 71' ' ' LYS . 11.3 mt -86.27 -58.56 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.927 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.714 ' CE3' ' CE1' ' B' ' 119' ' ' PHE . 13.2 t-105 -36.26 -55.78 0.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.58 ' HD2' HD23 ' B' ' 125' ' ' LEU . 0.0 OUTLIER -42.11 -41.77 2.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.912 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.58 HD23 ' HD2' ' B' ' 124' ' ' LYS . 98.6 mt -45.82 -46.05 15.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.722 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.8 OUTLIER -50.89 107.62 0.86 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.598 0.713 . . . . 0.0 110.887 179.919 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.422 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.6 Cg_endo -69.77 -6.78 19.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.229 . . . . 0.0 112.349 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.459 ' O ' HG21 ' A' ' 27' ' ' VAL . 0.2 OUTLIER 78.81 -3.24 2.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.905 -179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.788 0.327 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.656 HD12 ' HE2' ' A' ' 28' ' ' LYS . 5.6 mm 70.64 99.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.115 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.524 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -111.91 132.23 54.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.883 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.524 ' N ' HD22 ' A' ' 3' ' ' ASN . 3.5 mp0 -68.19 170.25 8.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.923 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.576 HG11 HD11 ' A' ' 84' ' ' LEU . 0.7 OUTLIER -152.36 172.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.505 ' N ' HG23 ' A' ' 5' ' ' VAL . 29.2 mtp85 -147.34 100.93 3.81 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.66 0.743 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.668 ' HG3' HD12 ' A' ' 15' ' ' LEU . 53.5 Cg_endo -69.82 118.83 5.91 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.673 2.248 . . . . 0.0 112.308 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 12' ' ' LEU . 5.9 mmtp -67.37 -166.83 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.513 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 7.9 mt -52.13 -61.97 3.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.617 0.723 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.2 Cg_endo -69.76 -2.41 10.13 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.656 2.237 . . . . 0.0 112.338 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -111.08 -16.54 13.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.869 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.742 HD22 ' CD2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -77.04 -42.6 37.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.897 179.92 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -26.94 68.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.5 mm -63.76 -54.47 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.746 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 26.4 mt -69.35 -41.18 76.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.911 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.742 ' CD2' HD22 ' A' ' 12' ' ' LEU . 7.7 m170 -55.93 -49.41 73.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.851 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.79 -13.49 24.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.095 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -101.55 6.02 42.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.111 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.04 -3.89 38.48 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.484 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.746 ' HB3' ' C ' ' A' ' 15' ' ' LEU . . . -68.64 -174.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.724 0.297 . . . . 0.0 111.072 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER 172.14 123.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' HD21 ' A' ' 12' ' ' LEU . . . 130.51 -147.97 18.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.486 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -144.4 14.82 1.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.901 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.547 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -148.6 141.44 24.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.879 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.547 ' CG ' ' O ' ' A' ' 24' ' ' MET . 61.1 m-85 -161.85 152.56 17.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.89 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.756 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -96.48 -177.08 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.135 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.419 ' H ' HG23 ' A' ' 27' ' ' VAL . 2.0 t -58.25 -40.98 79.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.656 ' HE2' HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -69.1 -50.38 48.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.903 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.596 ' O ' ' CD2' ' A' ' 33' ' ' TYR . 52.6 mt-10 -61.33 -38.63 87.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.848 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.854 HG11 HD21 ' A' ' 84' ' ' LEU . 83.6 t -68.56 -42.51 83.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.15 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.586 ' SD ' ' CZ2' ' B' ' 123' ' ' TRP . 0.0 OUTLIER -70.16 -42.7 72.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.8 t60 -56.77 -29.46 62.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.857 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.687 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 21.9 m-85 -74.45 -35.78 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.913 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.48 -58.96 4.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.916 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.401 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.78 -47.36 65.24 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.515 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.892 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -59.07 -43.35 91.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.773 0.32 . . . . 0.0 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -59.52 -47.55 85.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.932 HD13 HG21 ' A' ' 52' ' ' VAL . 68.7 mt -59.26 -49.01 85.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.155 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' CE ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -66.59 -25.18 66.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.87 179.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.462 ' N ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -74.73 -39.5 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.097 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.523 ' HB3' HD23 ' A' ' 43' ' ' LEU . 1.6 mmtp -90.76 -12.98 34.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.561 ' N ' HE21 ' A' ' 42' ' ' GLN . 0.0 OUTLIER 64.68 50.89 1.99 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.953 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.523 HD23 ' HB3' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -110.38 56.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.945 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -151.85 163.79 38.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -76.88 107.67 9.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.852 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.472 ' CB ' ' NE2' ' A' ' 47' ' ' GLN . 0.4 OUTLIER -50.05 -29.11 8.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' N ' ' A' ' 47' ' ' GLN . 7.1 mm-40 -79.34 -24.95 42.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.916 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -137.96 91.83 2.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -56.15 -25.52 46.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.704 ' HA ' HG22 ' A' ' 70' ' ' VAL . 2.0 p-80 -77.48 1.83 18.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.839 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.81 122.04 42.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.932 HG21 HD13 ' A' ' 38' ' ' ILE . 43.3 t -111.04 131.56 61.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -109.05 114.23 27.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.936 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.494 ' SG ' ' CD2' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -101.99 -33.57 9.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.878 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 66' ' ' GLN . . . 37.79 -94.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.461 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -128.53 52.24 0.83 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.471 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -118.22 -176.83 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 mt -52.8 -56.27 16.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.857 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 54' ' ' CYS . 0.4 OUTLIER -58.55 -36.48 73.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 54' ' ' CYS . . . -66.77 -43.37 91.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.524 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -66.74 -38.2 86.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.849 0.357 . . . . 0.0 110.908 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' ND2' ' A' ' 83' ' ' ASN . 10.3 tp -66.72 -48.44 69.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.795 HD21 ' O ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -68.07 -31.74 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.917 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 4.33 90.33 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -106.96 -167.9 1.34 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.736 0.303 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.0 OUTLIER -99.56 -48.89 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -157.58 150.6 23.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.855 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.708 ' CD2' HD13 ' A' ' 63' ' ' LEU . 27.4 p90 -142.69 156.38 45.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.913 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.506 ' O ' ' OD1' ' A' ' 72' ' ' ASP . 3.2 p -101.64 151.15 22.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.839 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.916 HG12 HG23 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -76.92 -15.88 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.119 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.593 ' HE3' ' CD2' ' A' ' 50' ' ' HIS . 8.1 ptpt -92.82 -11.87 32.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.606 ' CG ' ' O ' ' A' ' 72' ' ' ASP . 0.6 OUTLIER -111.77 95.29 27.6 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.595 0.712 . . . . 0.0 110.841 179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.617 ' HB2' ' CE2' ' A' ' 77' ' ' TYR . 54.3 Cg_endo -69.72 8.39 0.77 Allowed 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.679 2.253 . . . . 0.0 112.358 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.541 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -61.4 -65.18 2.32 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.672 0.748 . . . . 0.0 110.833 -179.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.795 ' O ' HD21 ' A' ' 63' ' ' LEU . 53.6 Cg_endo -69.74 -22.13 32.59 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.689 2.259 . . . . 0.0 112.32 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.698 HD22 ' CD2' ' B' ' 126' ' ' LEU . 5.7 tp -70.34 -59.31 2.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.877 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.617 ' CE2' ' HB2' ' A' ' 73' ' ' PRO . 29.1 m-85 -58.75 -40.8 84.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.946 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.8 -44.85 70.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.87 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.587 ' O ' ' CB ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -67.91 -45.11 75.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.917 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 HD23 ' A' ' 84' ' ' LEU . 26.0 mt -62.1 -35.84 79.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.914 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.469 ' CG ' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -49.68 -46.3 49.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -107.34 -0.76 22.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.587 ' CB ' ' O ' ' A' ' 79' ' ' MET . 39.8 t30 -101.53 -53.44 2.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.905 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.912 HD23 HD22 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.69 113.22 2.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -73.91 -5.14 6.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.147 179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 85' ' ' VAL . 5.6 p 36.14 -155.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.131 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.485 ' CD1' ' HB2' ' A' ' 4' ' ' GLN . 2.2 mt -104.83 -57.24 2.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.905 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -101.55 143.02 32.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.131 -179.888 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.836 0.35 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.08 77.17 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.933 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.724 ' C ' HG22 ' B' ' 118' ' ' THR . 21.2 tt0 73.29 -65.44 0.35 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.907 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.726 HG23 ' H ' ' B' ' 119' ' ' PHE . 0.0 OUTLIER 159.13 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.141 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.726 ' H ' HG23 ' B' ' 118' ' ' THR . 0.3 OUTLIER -50.31 -47.12 55.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.32 -16.25 32.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.903 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -72.69 -54.88 7.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.929 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.432 ' O ' HD13 ' B' ' 125' ' ' LEU . 0.9 OUTLIER -91.06 -41.26 11.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.933 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.586 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 36.2 t-105 -42.77 -49.05 5.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.924 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.404 ' C ' ' N ' ' B' ' 126' ' ' LEU . 4.8 mttt -43.3 -34.94 1.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.886 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.451 ' O ' ' CD ' ' B' ' 127' ' ' PRO . 0.4 OUTLIER -44.43 -22.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.9 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.812 HD11 ' O ' ' A' ' 70' ' ' VAL . 5.3 mp -106.12 73.45 0.29 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.612 0.72 . . . . 0.0 110.9 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' B' ' 128' ' ' GLU . 53.7 Cg_endo -69.77 -24.78 29.22 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 0.0 112.338 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' B' ' 127' ' ' PRO . 0.0 OUTLIER 158.1 -31.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.502 ' CA ' ' OH ' ' A' ' 77' ' ' TYR . 3.5 m120 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ILE . 10.8 mt-30 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.782 0.325 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.411 ' HA ' HG21 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -50.9 -175.57 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.5 HD22 ' N ' ' A' ' 4' ' ' GLN . 0.1 OUTLIER -171.12 130.46 0.76 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.91 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.5 ' N ' HD22 ' A' ' 3' ' ' ASN . 2.3 mp0 -68.82 160.44 30.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.612 HG21 HG21 ' A' ' 30' ' ' VAL . 0.8 OUTLIER -146.01 172.2 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.164 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.45 ' N ' HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -144.41 93.98 5.74 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.574 0.702 . . . . 0.0 110.887 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 108.84 2.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.718 2.279 . . . . 0.0 112.325 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.459 ' N ' ' HB2' ' A' ' 11' ' ' LEU . 6.6 mttm -66.79 -154.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 8.1 mt -63.76 -61.1 7.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.544 0.688 . . . . 0.0 110.89 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' LEU . 53.7 Cg_endo -69.79 -1.99 9.43 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.629 2.219 . . . . 0.0 112.377 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 83' ' ' ASN . 2.1 mt -114.53 -22.9 9.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.979 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 16' ' ' HIS . 10.4 tp -76.63 -54.07 7.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.939 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -35.46 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.907 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.445 HD11 HD21 ' A' ' 58' ' ' LEU . 2.6 mt -59.94 -53.87 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.145 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.699 ' C ' ' HB3' ' A' ' 20' ' ' ALA . 8.4 mt -67.99 -34.56 76.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.891 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 12' ' ' LEU . 1.8 m170 -58.81 -49.83 76.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.12 -26.25 68.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.971 ' HB1' ' HB2' ' A' ' 36' ' ' GLN . . . -82.5 3.65 27.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.61 14.69 29.1 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.793 ' HB2' ' CE1' ' A' ' 33' ' ' TYR . . . -94.54 171.37 8.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.713 0.292 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -171.93 104.85 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.926 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -165.21 30.1 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.452 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.34 1.75 5.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.553 ' O ' ' CG ' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -134.25 134.11 41.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' A' ' 24' ' ' MET . 42.5 m-85 -161.82 139.68 8.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.679 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -76.74 -174.61 3.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.143 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.481 HG21 ' O ' ' B' ' 129' ' ' ASN . 0.2 OUTLIER -64.48 -48.1 86.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.169 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' NZ ' ' OG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -62.94 -34.38 77.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.903 179.887 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -73.9 -46.42 44.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 26' ' ' THR . 97.6 t -64.15 -40.12 87.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.724 ' CE ' HD22 ' B' ' 126' ' ' LEU . 0.0 OUTLIER -68.35 -43.43 77.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.408 ' N ' ' HG3' ' A' ' 31' ' ' MET . 1.9 t60 -56.12 -29.13 60.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.793 ' CE1' ' HB2' ' A' ' 20' ' ' ALA . 22.9 m-85 -73.32 -35.55 66.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.919 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HB3' ' CZ2' ' B' ' 123' ' ' TRP . 0.6 OUTLIER -50.5 -57.71 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' N ' ' CZ2' ' B' ' 123' ' ' TRP . . . -53.82 -47.95 63.57 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.462 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.971 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -59.53 -41.53 90.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 0.0 110.929 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.464 ' OH ' ' CB ' ' A' ' 58' ' ' LEU . 79.3 t80 -61.22 -45.35 94.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.534 HD13 HG11 ' A' ' 52' ' ' VAL . 84.1 mt -61.84 -44.73 99.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.152 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.609 ' HA ' ' CE1' ' A' ' 44' ' ' TYR . 1.1 ptm -69.64 -27.46 65.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.858 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.11 -39.31 50.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.132 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.549 ' HB3' HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -91.55 -14.0 31.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.874 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.604 ' C ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER 73.03 69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.95 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.604 HD22 ' C ' ' A' ' 42' ' ' GLN . 2.9 mm? -133.84 48.81 2.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.609 ' CE1' ' HA ' ' A' ' 39' ' ' MET . 1.5 p90 -147.76 168.62 21.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.919 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' C ' ' A' ' 45' ' ' ASP . 13.0 t0 -94.12 99.43 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.899 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.564 ' H ' ' NE2' ' A' ' 46' ' ' GLN . 2.2 mp0 -47.95 -38.72 17.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' NE2' ' HB2' ' A' ' 46' ' ' GLN . 6.6 mm-40 -66.56 -29.73 69.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.423 ' HG2' ' CE1' ' A' ' 50' ' ' HIS . 2.5 mt-10 -143.59 90.72 2.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.861 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HG2' ' N ' ' B' ' 119' ' ' PHE . 1.7 mp0 -52.95 -17.61 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.915 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.594 ' O ' ' CD2' ' A' ' 50' ' ' HIS . 2.8 p-80 -82.74 14.33 3.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.89 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -136.48 98.56 3.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.955 HG23 HG12 ' A' ' 70' ' ' VAL . 62.9 t -92.81 129.67 43.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -108.01 104.13 13.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -66.81 -41.87 86.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.858 -179.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.445 ' N ' ' SG ' ' A' ' 54' ' ' CYS . . . 58.77 -81.38 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.512 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 54' ' ' CYS . . . -161.62 23.65 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.511 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.464 ' HB3' HD23 ' A' ' 59' ' ' LEU . 0.2 OUTLIER -84.36 -179.47 7.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.845 0.355 . . . . 0.0 110.83 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 58' ' ' LEU . 4.4 tt -46.59 -51.02 16.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.938 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 HD12 ' CZ ' ' A' ' 68' ' ' PHE . 2.6 pt? -59.72 -39.84 85.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.872 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' N ' ' HG ' ' A' ' 59' ' ' LEU . . . -59.67 -52.06 55.32 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.513 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -61.38 -45.6 93.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.883 0.373 . . . . 0.0 110.922 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -51.96 60.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.926 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD22 ' HD3' ' A' ' 65' ' ' ARG . 0.5 OUTLIER -71.62 -60.11 2.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 106.24 17.38 12.73 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.638 ' HD3' HD22 ' A' ' 63' ' ' LEU . 1.3 mpt_? -118.88 -168.5 1.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -95.42 -52.4 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.2 p -151.15 -177.49 6.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' ' HB ' ' A' ' 52' ' ' VAL . 5.7 p90 -170.39 145.78 2.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.75 136.48 35.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.836 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.955 HG12 HG23 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -77.13 -41.23 30.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' N ' ' CG2' ' A' ' 70' ' ' VAL . 3.1 ttmt -65.82 -9.7 31.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.407 ' HA ' ' HD2' ' A' ' 73' ' ' PRO . 49.3 t0 -119.92 94.68 48.76 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.594 0.711 . . . . 0.0 110.897 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HG3' ' CD ' ' B' ' 127' ' ' PRO . 53.5 Cg_endo -69.81 57.16 1.48 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.704 2.269 . . . . 0.0 112.294 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.614 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 0.4 OUTLIER -97.53 -69.48 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.634 0.73 . . . . 0.0 110.82 -179.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.614 ' CD ' ' CB ' ' A' ' 74' ' ' SER . 53.6 Cg_endo -69.8 -27.62 26.08 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.692 2.262 . . . . 0.0 112.326 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.662 HD22 HD21 ' B' ' 126' ' ' LEU . 10.1 tp -58.95 -61.16 2.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.905 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -55.35 -46.24 76.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.909 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.47 ' HA ' ' CD ' ' A' ' 81' ' ' ARG . 4.1 t0 -52.16 -27.8 15.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -81.41 -50.63 9.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.917 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' O ' ' A' ' 76' ' ' LEU . 9.2 mp -52.63 -35.41 54.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.47 ' CD ' ' HA ' ' A' ' 78' ' ' ASP . 19.1 mtp85 -34.55 -58.0 0.5 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HD2' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -108.04 -1.55 20.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.627 ' O ' HD11 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -91.98 -52.35 4.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.871 179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.025 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -85.4 145.92 27.23 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.405 ' CG1' ' N ' ' A' ' 86' ' ' THR . 0.9 OUTLIER -89.3 152.89 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.136 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.405 ' N ' ' CG1' ' A' ' 85' ' ' VAL . 0.8 OUTLIER -151.56 116.72 5.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.146 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.725 ' N ' HD23 ' A' ' 87' ' ' LEU . 0.1 OUTLIER -102.25 85.18 2.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -163.01 -177.7 5.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.063 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.107 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.814 0.34 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' GLN . . . . . 0.474 ' NE2' ' N ' ' B' ' 117' ' ' GLU . 0.0 OUTLIER -74.57 121.28 21.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.911 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.474 ' N ' ' NE2' ' B' ' 116' ' ' GLN . 16.2 tp10 -167.15 -49.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' THR . . . . . 0.762 HG23 ' N ' ' B' ' 119' ' ' PHE . 3.1 t -179.54 -151.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.181 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' PHE . . . . . 0.762 ' N ' HG23 ' B' ' 118' ' ' THR . 0.2 OUTLIER -37.89 -42.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.88 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.58 -43.31 46.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.842 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 118' ' ' THR . 31.4 t70 -50.78 -64.66 0.74 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.87 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . 0.551 HD23 ' N ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -75.96 -56.97 4.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.887 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.585 ' CZ2' ' SD ' ' A' ' 31' ' ' MET . 29.3 t-105 -34.05 -57.31 0.47 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.0 mmtt -43.52 -43.68 5.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.939 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 122' ' ' LEU . 2.1 tm? -40.08 -44.97 1.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.724 HD22 ' CE ' ' A' ' 31' ' ' MET . 0.6 OUTLIER -37.76 136.45 0.74 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.606 0.717 . . . . 0.0 110.907 179.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.474 ' C ' ' CG ' ' B' ' 128' ' ' GLU . 54.3 Cg_endo -69.7 -22.45 32.34 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.663 2.242 . . . . 0.0 112.327 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' GLU . . . . . 0.474 ' CG ' ' C ' ' B' ' 127' ' ' PRO . 0.6 OUTLIER 64.12 -73.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.9 -179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' ASN . . . . . 0.481 ' O ' HG21 ' A' ' 27' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.911 -179.941 . . . . . . . . 2 2 . 1 stop_ save_