data_2kua_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 2kua _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.877 0.37 . . . . 75.230000000000004 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 110.854 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.445 HG22 ' CD1' ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.549 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.420000000000002 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.349999999999994 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.639 ' CD1' ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.44 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 64.409999999999997 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.475 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.523 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 72.439999999999998 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.400000000000006 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 73.049999999999997 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 72.140000000000001 111.118 179.951 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.979 0.419 . . . . 71.010000000000005 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 74.219999999999999 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.655 ' OE1' ' N ' ' A' ' 39' ' ' ALA . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.319999999999993 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 75.019999999999996 111.109 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.559 HD11 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.230000000000004 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' ' CD2' ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.430000000000007 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 63.210000000000001 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.453 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.219999999999999 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.619 ' CG2' ' N ' ' A' ' 46' ' ' THR . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.619 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 46' ' ' THR . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.209999999999994 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.497 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.519999999999996 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.463 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.540000000000006 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.493 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 75.8 m-70 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.209999999999994 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 73.530000000000001 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.230000000000004 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.239999999999995 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 74.25 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.349999999999994 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.400000000000006 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.439999999999998 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.329999999999998 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.310000000000002 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.140000000000001 110.952 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.409999999999997 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.140000000000001 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.466 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.230000000000004 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.210000000000001 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.607 ' N ' ' CD1' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 71.349999999999994 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.522 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 72.299999999999997 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 75.430000000000007 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.239999999999995 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 93' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 52.130000000000003 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.515 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 74.129999999999995 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.439999999999998 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.606 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.578 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 75.530000000000001 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.465 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.509999999999998 110.888 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.129999999999995 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 52.219999999999999 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.576 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 74.510000000000005 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.230000000000004 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.678 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.210000000000001 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.51 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.120000000000005 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.576 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.120000000000005 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.591 HG12 ' CZ ' ' A' ' 154' ' ' PHE . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.040000000000006 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.449 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 75.299999999999997 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 75' ' ' ALA . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 75.299999999999997 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 75.140000000000001 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.445 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.340000000000003 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.649 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.319999999999993 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.537 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.120000000000005 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 74.019999999999996 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.340000000000003 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.567 ' CD2' ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.493 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 75.049999999999997 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.568 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 74.420000000000002 110.921 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.494 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.913 0.387 . . . . 74.109999999999999 111.161 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.319999999999993 111.167 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.541 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 75.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.200000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.524 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.010000000000005 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.456 ' CD2' ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 73.430000000000007 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 75.430000000000007 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.1 t-20 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 75.340000000000003 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.239999999999995 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.537 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 63.520000000000003 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.349999999999994 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 73.319999999999993 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.547 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.200000000000003 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.457 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 43.32 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 74.540000000000006 110.907 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 71.420000000000002 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.578 ' CE1' ' O ' ' A' ' 80' ' ' SER . 6.6 m-70 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.010000000000005 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.049999999999997 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.135 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.48 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 74.219999999999999 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.458 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 53.039999999999999 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.150000000000006 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.678 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 75.109999999999999 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.209999999999994 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 71.109999999999999 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.450000000000003 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.239999999999995 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.591 ' CZ ' HG12 ' A' ' 91' ' ' VAL . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.450000000000003 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.48 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.520000000000003 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.540000000000006 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.463 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 71.329999999999998 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 74.310000000000002 110.96 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 73.340000000000003 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.465 HG21 ' CD1' ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 74.400000000000006 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.109999999999999 110.902 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.319999999999993 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.459 HD23 ' CG ' ' A' ' 38' ' ' GLU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 133' ' ' TYR . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 71.030000000000001 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.319999999999993 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.409999999999997 110.875 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.57 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.546 HG13 ' CG2' ' A' ' 129' ' ' VAL . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.010000000000005 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 64.120000000000005 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.613 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.340000000000003 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 62.32 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.329999999999998 111.117 179.974 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.957 0.408 . . . . 73.319999999999993 110.835 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.450000000000003 111.084 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.484 ' OE1' ' CG ' ' A' ' 151' ' ' TRP . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 73.420000000000002 111.092 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.230000000000004 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.465 HD23 ' CG1' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.040000000000006 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 74.049999999999997 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.519999999999996 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.438 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.340000000000003 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.631 ' CG2' ' N ' ' A' ' 46' ' ' THR . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 75.409999999999997 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.631 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 75.230000000000004 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.471 ' N ' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 75.040000000000006 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.502 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 65.530000000000001 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.109999999999999 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.430000000000007 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.61 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 74.310000000000002 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.430000000000007 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 74.030000000000001 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.61 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 73.430000000000007 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 74.099999999999994 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 71.040000000000006 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.230000000000004 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.299999999999997 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.434 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.240000000000002 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.409999999999997 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 75.230000000000004 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.529 ' N ' ' ND2' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 74.510000000000005 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.508 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.420000000000002 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 75.420000000000002 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.200000000000003 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.040000000000006 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.219999999999999 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 75.109999999999999 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.665 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.519999999999996 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 65.099999999999994 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.129999999999995 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.340000000000003 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.557 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.209999999999994 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.598 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 75.420000000000002 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 110.894 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.409999999999997 110.923 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.586 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.450000000000003 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 65.310000000000002 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.621 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 74.230000000000004 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 73.310000000000002 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 75.239999999999995 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.350000000000001 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.150000000000006 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' CD2' ' A' ' 85' ' ' PHE . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.485 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.435 ' O ' ' SD ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.25 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.423 HD23 ' CB ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 74.230000000000004 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.57 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 74.230000000000004 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.436 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.409999999999997 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.665 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.439999999999998 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.541 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.57 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 72.430000000000007 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.51 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.140000000000001 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.51 ' CD2' HG23 ' A' ' 99' ' ' THR . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.481 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 73.209999999999994 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.495 ' N ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.349999999999994 110.901 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.918 0.389 . . . . 73.430000000000007 111.142 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.414 HG22 ' N ' ' A' ' 123' ' ' ARG . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 75.140000000000001 111.087 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.414 ' N ' HG22 ' A' ' 122' ' ' THR . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 73.219999999999999 110.977 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.457 ' CB ' ' HE2' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.517 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.140000000000001 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.567 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.567 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 73.239999999999995 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.030000000000001 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.541 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.209999999999994 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.514 ' O ' ' CB ' ' A' ' 137' ' ' MET . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.409999999999997 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 62.219999999999999 110.896 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.562 ' CD2' ' C ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.310000000000002 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.514 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.319999999999993 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.230000000000004 110.853 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.445 ' HG3' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 13.1 m-70 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.219999999999999 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.409999999999997 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 71.150000000000006 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 71.150000000000006 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.464 ' C ' HD12 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.240000000000002 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.444 ' N ' HD12 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.140000000000001 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 73.430000000000007 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.140000000000001 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.329999999999998 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.099999999999994 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 61.329999999999998 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.485 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.409999999999997 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.464 ' SG ' ' N ' ' A' ' 156' ' ' ARG . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.109999999999999 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.340000000000003 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.532 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.239999999999995 110.954 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 75.129999999999995 110.844 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.828 0.347 . . . . 73.310000000000002 110.868 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 75.150000000000006 110.91 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.464 ' CG2' HD23 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.400000000000006 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 70.030000000000001 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.505 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.419 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 70.319999999999993 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.925 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.239999999999995 110.837 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.509 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.109999999999999 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 111.038 -179.954 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 71.319999999999993 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 111.106 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.469 ' CG ' HD21 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.299999999999997 111.115 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.589 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.510000000000005 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.657 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 71.510000000000005 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 74.230000000000004 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.46 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 73.530000000000001 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.528 ' CG2' ' N ' ' A' ' 46' ' ' THR . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 64.219999999999999 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.657 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.219999999999999 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 75.209999999999994 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.498 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 73.420000000000002 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.506 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 76.9 m-70 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.030000000000001 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.530000000000001 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.239999999999995 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.404 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.510000000000005 110.794 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.200000000000003 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.140000000000001 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 60.229999999999997 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 63.229999999999997 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.150000000000006 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.594 ' N ' ' ND2' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.400000000000006 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.493 ' NE ' ' O ' ' A' ' 65' ' ' GLY . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 72.030000000000001 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 71.230000000000004 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 70.120000000000005 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.603 ' N ' ' CD1' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.565 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.329999999999998 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.565 ' N ' ' CG1' ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 62.450000000000003 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 74.409999999999997 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.456 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 63.030000000000001 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 72.109999999999999 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 72.530000000000001 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.541 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 73.109999999999999 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.573 HD13 ' CD2' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 75.209999999999994 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 73.230000000000004 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 71.519999999999996 110.9 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 70.030000000000001 110.946 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.219999999999999 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.573 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 63.229999999999997 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.210000000000001 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.69 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 61.450000000000003 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 74.109999999999999 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.575 HD22 ' CE3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 72.239999999999995 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.329999999999998 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.465 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 75.409999999999997 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.486 ' CD2' ' C ' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.219999999999999 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.481 HD13 ' CD2' ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 75.040000000000006 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.475 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.430000000000007 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.652 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.409999999999997 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.47 ' CB ' HD23 ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 62.149999999999999 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 61.109999999999999 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.494 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.399999999999999 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.555 HD12 ' CD2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 73.099999999999994 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.482 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 72.150000000000006 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.462 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.109999999999999 110.862 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' A' ' 122' ' ' THR . 7.7 p . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.152 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.437 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.540000000000006 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 74.230000000000004 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.519999999999996 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.505 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 72.340000000000003 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 70.120000000000005 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.549 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.430000000000007 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.549 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 71.019999999999996 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.329999999999998 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.567 ' CD1' HD21 ' A' ' 135' ' ' LEU . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 132' ' ' LEU . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 63.210000000000001 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.489 ' O ' ' CB ' ' A' ' 137' ' ' MET . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.43 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 72.209999999999994 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.585 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.475 HD21 ' N ' ' A' ' 137' ' ' MET . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 71.409999999999997 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.489 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 72.129999999999995 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 74.25 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.329999999999998 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 75.239999999999995 110.845 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.099999999999994 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.507 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.140000000000001 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.549999999999997 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.209999999999994 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.619 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.420000000000002 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.474 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 74.319999999999993 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.319999999999993 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.69 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.010000000000005 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.474 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.310000000000002 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.408 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 65.219999999999999 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.020000000000003 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.340000000000003 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.494 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 62.509999999999998 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.581 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.040000000000006 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.419 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.409999999999997 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.471 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.209999999999994 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 71.349999999999994 110.912 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.841 0.353 . . . . 64.230000000000004 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.425 ' CD ' ' N ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.488 ' CG2' ' CD2' ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.329999999999998 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 74.239999999999995 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 71.430000000000007 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 75.299999999999997 110.958 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 75.430000000000007 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.209999999999994 110.912 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.585 ' CE1' HG22 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.510000000000005 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 129' ' ' VAL . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 74.409999999999997 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 73.329999999999998 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 73.150000000000006 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 73.239999999999995 111.067 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.856 0.36 . . . . 73.329999999999998 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.519999999999996 111.177 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.515 ' CD ' ' CD2' ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.010000000000005 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 111.108 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.569 HD12 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.340000000000003 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' THR . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.310000000000002 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 73.510000000000005 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.42 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.409999999999997 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.634 ' CG2' ' N ' ' A' ' 46' ' ' THR . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.040000000000006 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.634 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.519 ' N ' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.485 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.409999999999997 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.562 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.030000000000001 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.596 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.7 m-70 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 74.239999999999995 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.430000000000007 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.219999999999999 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.340000000000003 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.596 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.403 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.907 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.510000000000005 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.403 ' SG ' ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 74.049999999999997 110.832 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 75.319999999999993 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 71.140000000000001 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.209999999999994 110.878 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.340000000000003 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 75.010000000000005 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.569 ' HE ' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 71.510000000000005 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.239999999999995 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 74.299999999999997 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.099999999999994 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.530000000000001 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.664 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 74.099999999999994 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.010000000000005 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.519 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 63.32 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.53 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.129999999999995 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.593 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.140000000000001 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.510000000000005 110.847 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.476 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 73.239999999999995 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.210000000000001 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 75.150000000000006 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.329999999999998 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CD2' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 72.430000000000007 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 74.510000000000005 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.409999999999997 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.310000000000002 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.509 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.219999999999999 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.577 HD13 ' CE1' ' A' ' 141' ' ' HIS . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 74.409999999999997 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.63 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.040000000000006 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.424 ' HE3' ' C ' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.299999999999997 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.436 HD11 ' CD2' ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 75.109999999999999 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.522 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 74.420000000000002 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 75.010000000000005 111.126 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.664 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 74.239999999999995 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.545 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 73.340000000000003 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.439999999999998 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.605 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 74.329999999999998 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.451 ' HE2' ' CG2' ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 73.340000000000003 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.568 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.329999999999998 110.904 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.867 0.365 . . . . 73.109999999999999 111.158 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.439999999999998 111.149 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.319999999999993 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.541 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 62.350000000000001 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.58 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.58 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 75.140000000000001 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.530000000000001 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.120000000000005 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.545 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.540000000000006 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.540000000000006 110.926 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 73.120000000000005 110.904 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 74.420000000000002 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HA ' ' CE1' ' A' ' 141' ' ' HIS . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 73.230000000000004 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 110.912 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.430000000000007 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.439999999999998 110.9 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.475 ' O ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.409999999999997 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 74.549999999999997 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.420000000000002 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.478 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 63.439999999999998 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.459 ' N ' HD12 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.340000000000003 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 54.109999999999999 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 62.219999999999999 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' GLY . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.310000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 71.209999999999994 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.63 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 73.030000000000001 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 156' ' ' ARG . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.310000000000002 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.574 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.407 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 74.120000000000005 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.426 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.010000000000005 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 63.119999999999997 110.901 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.799 0.333 . . . . 61.039999999999999 110.844 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.472 ' CG2' HD22 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.430000000000007 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.5 110.925 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 73.230000000000004 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.239999999999995 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.456 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 110.874 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 71.299999999999997 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.545 HG13 ' CG2' ' A' ' 129' ' ' VAL . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 74.510000000000005 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.633 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.240000000000002 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.549999999999997 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 71.239999999999995 111.09 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.916 0.389 . . . . 73.209999999999994 110.805 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 111.145 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.150000000000006 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.400000000000006 111.058 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.130000000000003 111.12 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.589 ' HG ' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 70.209999999999994 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 73.439999999999998 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.89 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 71.150000000000006 110.922 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.491 ' CG2' ' N ' ' A' ' 46' ' ' THR . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 72.200000000000003 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.643 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.039999999999999 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.439999999999998 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.521 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 75.200000000000003 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.549999999999997 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.564 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.239999999999995 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.9 m-70 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.150000000000006 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.030000000000001 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.340000000000003 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.219999999999999 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 64.340000000000003 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 73.010000000000005 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 73.439999999999998 110.864 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 71.109999999999999 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.340000000000003 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.474 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 74.120000000000005 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 61.450000000000003 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.532 HD12 ' CE1' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.531 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 73.319999999999993 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.349999999999994 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.439999999999998 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.559 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 62.340000000000003 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.51 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.450000000000003 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.543 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 75.319999999999993 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.569 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 63.210000000000001 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.310000000000002 110.885 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.540000000000006 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 61.310000000000002 110.826 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.612 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 70.019999999999996 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.65 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 74.549999999999997 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.656 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.230000000000004 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 74.430000000000007 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 85' ' ' PHE . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 72.310000000000002 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.59 HG11 ' CZ ' ' A' ' 154' ' ' PHE . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 73.019999999999996 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.456 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.483 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.519999999999996 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.46 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.649 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 75.420000000000002 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.546 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.400000000000006 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.140000000000001 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 75.510000000000005 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.598 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.319999999999993 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.498 ' HE2' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 72.150000000000006 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.511 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 72.430000000000007 110.971 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.492 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.919 0.39 . . . . 73.109999999999999 111.144 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.521 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 74.340000000000003 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.521 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.409999999999997 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.484 ' HA ' ' CD2' ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.129999999999995 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.536 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.040000000000006 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.565 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 70.030000000000001 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.566 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.566 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 74.430000000000007 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.030000000000001 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.546 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 74.450000000000003 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.559 ' CD1' ' CB ' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.472 HD22 ' CG2' ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.319999999999993 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.32 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 75.340000000000003 110.892 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 73.230000000000004 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.547 ' NH1' ' CD1' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 72.349999999999994 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.547 ' CD1' ' NH1' ' A' ' 142' ' ' ARG . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.030000000000001 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.340000000000003 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.656 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.030000000000001 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.477 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 41.439999999999998 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 65.019999999999996 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.099999999999994 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 74.120000000000005 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.59 ' CZ ' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.530000000000001 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.556 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.463 ' CB ' HD13 ' A' ' 41' ' ' LEU . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 71.109999999999999 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.471 ' CB ' HD23 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.140000000000001 110.933 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.865 0.364 . . . . 74.140000000000001 110.895 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.209999999999994 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.451 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 70.219999999999999 110.919 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.487 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.430000000000007 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.140000000000001 110.842 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.239999999999995 110.864 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.568 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 73.450000000000003 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.538 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 73.019999999999996 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.239999999999995 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.209999999999994 111.044 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.919 0.39 . . . . 45.5 110.875 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.209999999999994 111.077 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.499 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.140000000000001 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 63.219999999999999 111.097 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.409999999999997 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.664 ' CD1' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.239999999999995 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.603 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.209999999999994 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.430000000000007 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.479 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.239999999999995 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.53 ' CG2' ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 73.209999999999994 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.603 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 75.319999999999993 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.48 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 74.230000000000004 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.149999999999999 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 72.340000000000003 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.329999999999998 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.329999999999998 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 75.299999999999997 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.140000000000001 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 72.140000000000001 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 71.540000000000006 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.439999999999998 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 72.230000000000004 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 63.420000000000002 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.439999999999998 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.435 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.329999999999998 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 73.299999999999997 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.459 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.430000000000007 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 110.923 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.544 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 73.420000000000002 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.569 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.120000000000005 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.019999999999996 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.554 ' CG ' ' O ' ' A' ' 74' ' ' MET . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 73.430000000000007 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.547 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.613 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 73.129999999999995 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.409999999999997 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 73.5 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 72.099999999999994 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.72 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 72.099999999999994 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.627 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.439999999999998 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.109999999999999 110.838 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.483 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.582 HD13 ' CZ3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.627 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.487 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.439 ' CG ' HD21 ' A' ' 132' ' ' LEU . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.519999999999996 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.501 ' CD2' ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.109999999999999 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.506 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.634 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.230000000000004 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.522 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.150000000000006 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.230000000000004 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.409999999999997 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.634 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 63.450000000000003 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.506 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.549999999999997 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.503 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 75.299999999999997 110.847 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.919 0.39 . . . . 74.340000000000003 111.143 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.413 ' O ' ' SG ' ' A' ' 125' ' ' CYS . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 75.239999999999995 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.899 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.040000000000006 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.516 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 75.099999999999994 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.239999999999995 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 70.109999999999999 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.564 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.409999999999997 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.564 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 75.219999999999999 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.506 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 71.319999999999993 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.522 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.400000000000006 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.58 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 74.099999999999994 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.451 ' ND2' ' C ' ' A' ' 134' ' ' ASN . 0.4 OUTLIER -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.824 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.547 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 72.349999999999994 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.508 ' CD1' ' CZ2' ' A' ' 151' ' ' TRP . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.040000000000006 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.58 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.530000000000001 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.049999999999997 112.492 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.485 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.420000000000002 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.475 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 74.200000000000003 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.420000000000002 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . 0.485 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.129999999999995 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.485 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.448 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 71.439999999999998 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.239999999999995 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.430000000000007 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 73.120000000000005 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.438 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 73.319999999999993 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.508 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.230000000000004 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.119999999999997 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.019999999999996 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.664 ' CZ ' ' CD1' ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.109999999999999 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.150000000000006 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.457 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.457 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.439999999999998 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 74.040000000000006 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.510000000000005 110.918 179.903 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' O ' ' CD ' ' A' ' 10' ' ' GLU . 15.1 tm-20 . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.91 0.386 . . . . 74.319999999999993 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.210000000000001 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.463 ' CG2' HD12 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.537 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 74.120000000000005 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.519999999999996 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.430000000000007 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.563 ' CE1' HG22 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.329999999999998 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 129' ' ' VAL . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.329999999999998 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.639 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.010000000000005 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.075 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.843 0.354 . . . . 74.120000000000005 110.888 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 75.030000000000001 111.145 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.469 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 74.400000000000006 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.049999999999997 111.121 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB1' ' ND2' ' A' ' 160' ' ' ASN . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 63.310000000000002 111.157 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.631 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.412 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 74.040000000000006 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 46' ' ' THR . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 72.019999999999996 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.631 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.319999999999993 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.329999999999998 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.030000000000001 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.489 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.240000000000002 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.319999999999993 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.491 ' OE2' ' NE2' ' A' ' 48' ' ' GLN . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.349999999999994 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.010000000000005 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.310000000000002 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.130000000000003 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.099999999999994 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 73.319999999999993 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.409999999999997 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 74.310000000000002 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 57' ' ' PHE . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 72.319999999999993 110.886 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.219999999999999 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.549999999999997 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.310000000000002 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.319999999999993 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.497 ' CZ ' ' OD1' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.439999999999998 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.476 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.553 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 75.319999999999993 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.540000000000006 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.349999999999994 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.581 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.109999999999999 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.451 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 55.210000000000001 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.150000000000006 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.542 ' CG ' ' O ' ' A' ' 74' ' ' MET . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.537 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.409999999999997 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.594 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.319999999999993 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.468 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.340000000000003 110.838 -179.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.419 ' HA ' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 73.420000000000002 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.299999999999997 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 72.549999999999997 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.63 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.430000000000007 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.119999999999997 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.688 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.340000000000003 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.239999999999995 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.571 HD22 ' CE2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.450000000000003 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.691 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.416 ' O ' ' SD ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.5 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.430000000000007 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.474 HD13 ' CD1' ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.530000000000001 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.461 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 72.150000000000006 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.623 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.561 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.539 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.319999999999993 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 75.140000000000001 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.623 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 70.209999999999994 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.508 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 75.409999999999997 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.955 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.867 0.365 . . . . 72.519999999999996 111.114 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.428 HG21 ' N ' ' A' ' 123' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.518 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.019999999999996 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.129999999999995 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.529 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 75.219999999999999 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.230000000000004 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.349999999999994 110.902 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.551 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 75.030000000000001 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.551 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.030000000000001 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.349999999999994 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.561 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.219999999999999 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.403 ' O ' HD11 ' A' ' 136' ' ' LEU . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 75.120000000000005 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 61.420000000000002 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 110.887 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.478 HD11 ' N ' ' A' ' 137' ' ' MET . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 75.340000000000003 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.478 ' N ' HD11 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.340000000000003 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 73.120000000000005 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.477 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.519999999999996 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.419 ' CD ' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 72.340000000000003 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.468 ' CE1' ' O ' ' A' ' 80' ' ' SER . 25.5 m-70 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 72.329999999999998 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.129999999999995 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.539999999999999 110.791 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.532 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 71.140000000000001 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.465 ' N ' HD11 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 63.0 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 75.549999999999997 111.142 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.688 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 62.450000000000003 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 73.230000000000004 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 73.319999999999993 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.340000000000003 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.349999999999994 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 74.510000000000005 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.691 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 74.219999999999999 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 65.420000000000002 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.58 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 54.409999999999997 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.522 ' CD1' ' CD1' ' A' ' 154' ' ' PHE . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.439999999999998 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.413 ' ND2' ' HB1' ' A' ' 40' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.209999999999994 110.842 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.91 0.386 . . . . 75.129999999999995 110.948 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.818 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 74.439999999999998 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' NH1' ' CD1' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 75.230000000000004 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.481 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.481 ' N ' ' HD3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.471 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 72.409999999999997 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 110.842 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 34.240000000000002 110.825 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.538 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.219999999999999 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 75.540000000000006 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.638 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.448 ' CB ' HG23 ' A' ' 121' ' ' VAL . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.119999999999997 111.097 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.933 0.397 . . . . 65.239999999999995 110.854 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 75.099999999999994 111.197 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.507 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.109999999999999 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.200000000000003 111.124 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 73.340000000000003 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.549999999999997 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 73.450000000000003 110.875 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.515 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 74.099999999999994 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.609 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 55.409999999999997 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.524 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.478 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 75.400000000000006 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.019999999999996 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.602 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.8 m-70 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.549999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.019999999999996 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.609 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.450000000000003 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.119999999999997 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 64.019999999999996 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.752 ' CE1' ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.109999999999999 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.530000000000001 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.019999999999996 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 44.329999999999998 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.329999999999998 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.476 ' CZ ' ' OD1' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.752 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.52 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.219999999999999 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.676 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 73.219999999999999 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.467 ' HB2' ' CD2' ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 71.219999999999999 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.409999999999997 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.55 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 75.450000000000003 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.510000000000005 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.476 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.420000000000002 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.532 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.340000000000003 110.861 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.319999999999993 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.611 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.319999999999993 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 74.420000000000002 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.239999999999995 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.514 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.564 HD23 ' CE2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 74.150000000000006 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.57 HG12 ' CZ ' ' A' ' 154' ' ' PHE . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.437 ' O ' ' SD ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.467 ' CD2' ' HB2' ' A' ' 75' ' ' ALA . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.420000000000002 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.481 ' CD1' ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.319999999999993 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.426 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 74.239999999999995 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.676 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.566 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 72.519999999999996 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.239999999999995 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.509 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.519999999999996 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.509 ' CD2' HG21 ' A' ' 99' ' ' THR . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 74.010000000000005 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.478 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.239999999999995 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.310000000000002 110.882 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.448 HG23 ' CB ' ' A' ' 24' ' ' ALA . 6.7 p . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.876 0.37 . . . . 74.200000000000003 111.114 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.417 ' O ' ' SG ' ' A' ' 125' ' ' CYS . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.120000000000005 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.140000000000001 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.446 ' OD1' ' CG ' ' A' ' 67' ' ' ARG . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.498 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.420000000000002 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.51 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 63.399999999999999 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.55 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 65.120000000000005 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.55 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.472 ' C ' ' ND2' ' A' ' 130' ' ' ASN . 0.3 OUTLIER -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.439999999999998 110.911 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.566 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 74.319999999999993 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.57 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.349999999999994 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.340000000000003 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.299999999999997 110.93 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.463 HD13 ' CZ2' ' A' ' 151' ' ' TRP . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.57 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.210000000000001 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.400000000000006 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.476 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 74.140000000000001 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 72.299999999999997 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 73.439999999999998 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 73.420000000000002 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.535 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 74.450000000000003 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.472 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.099999999999994 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.030000000000001 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.450000000000003 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.409999999999997 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.463 ' CZ2' HD13 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.239999999999995 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.530000000000001 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 70.209999999999994 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.573 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.319999999999993 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.562 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.409999999999997 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 74.409999999999997 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.588 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 75.109999999999999 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 75.519999999999996 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.487 ' CB ' HD21 ' A' ' 41' ' ' LEU . 2.1 t30 . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 72.319999999999993 110.888 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.833 0.349 . . . . 72.120000000000005 110.861 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.310000000000002 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.425 HG22 ' CD2' ' A' ' 133' ' ' TYR . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.040000000000006 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 75.319999999999993 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 62.32 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.457 ' CD1' HD21 ' A' ' 94' ' ' LEU . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.430000000000007 110.868 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 74.340000000000003 110.845 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.512 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 75.400000000000006 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.515 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 73.400000000000006 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.510000000000005 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.120000000000005 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.409999999999997 111.121 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.858 0.361 . . . . 65.310000000000002 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.049999999999997 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.543 ' OE1' ' CG ' ' A' ' 151' ' ' TRP . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.420000000000002 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 111.073 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.219999999999999 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.554 HD11 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.508 HD13 ' CB ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.219999999999999 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.340000000000003 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.485 ' CG2' ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.503 ' CB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.439999999999998 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.496 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.450000000000003 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.482 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.329999999999998 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 74.519999999999996 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.299999999999997 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 65.129999999999995 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.3 m-70 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.409999999999997 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 62.439999999999998 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 70.310000000000002 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 75.319999999999993 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.109999999999999 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 75.549999999999997 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.420000000000002 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 74.430000000000007 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.030000000000001 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.209999999999994 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.508 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.481 ' N ' ' CD1' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 70.430000000000007 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.539 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 74.349999999999994 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 75.540000000000006 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 72.299999999999997 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.576 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.56 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 65.010000000000005 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.230000000000004 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.51 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 60.420000000000002 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.518 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.530000000000001 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.604 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 72.209999999999994 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.768 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.41 ' HA ' ' NE2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.340000000000003 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.83 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.599 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 63.539999999999999 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.569 ' CE2' HD11 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.150000000000006 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.439999999999998 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 75.219999999999999 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 75.409999999999997 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 63.32 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 74.150000000000006 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.503 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.433 ' O ' ' SD ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.120000000000005 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.508 ' CB ' HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.129999999999995 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.491 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 65.340000000000003 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.420000000000002 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.512 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.530000000000001 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.49 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.409999999999997 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.599 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 55.229999999999997 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 75.530000000000001 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.516 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.439999999999998 110.948 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.899 0.38 . . . . 74.409999999999997 111.121 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.539 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.120000000000005 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.539 ' N ' ' CG2' ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.310000000000002 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.878 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.514 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.219999999999999 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.439999999999998 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.559 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 75.140000000000001 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.559 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 72.010000000000005 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.476 ' HB3' ' CD1' ' A' ' 93' ' ' LEU . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 75.129999999999995 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.492 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.409999999999997 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 71.319999999999993 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.56 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.329999999999998 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.492 ' CD2' ' O ' ' A' ' 133' ' ' TYR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.905 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.319999999999993 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.450000000000003 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.299999999999997 110.826 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 64.400000000000006 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.409999999999997 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.483 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.530000000000001 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.48 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.239999999999995 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.439999999999998 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.48 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.200000000000003 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.239999999999995 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.509999999999998 112.494 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.340000000000003 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.310000000000002 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.479 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.409999999999997 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.431 ' CD1' ' HD1' ' A' ' 157' ' ' PHE . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.219999999999999 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 71.040000000000006 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 73.409999999999997 110.9 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.795 0.331 . . . . 71.209999999999994 110.844 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.455 ' CG2' HD13 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 72.310000000000002 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.806 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 73.150000000000006 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.509 ' C ' ' CD1' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 110.93 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 75.349999999999994 110.815 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.439999999999998 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.510000000000005 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.521 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.409999999999997 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 74.319999999999993 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.349999999999994 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.135 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.93 0.395 . . . . 74.319999999999993 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.161 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 72.129999999999995 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.140000000000001 111.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.140000000000001 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.61 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 73.420000000000002 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 71.329999999999998 110.842 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 74.239999999999995 110.85 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.542 HG12 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 72.430000000000007 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.61 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 73.299999999999997 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 65.530000000000001 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.514 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.43 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.469 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.099999999999994 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 75.439999999999998 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.534 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.61 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 64.2 m-70 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 73.099999999999994 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.109999999999999 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.030000000000001 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.61 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.530000000000001 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.408 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.340000000000003 110.897 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.340000000000003 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.400000000000006 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.310000000000002 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.229999999999997 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.510000000000005 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.310000000000002 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.130000000000003 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.58 ' N ' ' ND2' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.310000000000002 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.493 ' NE ' ' O ' ' A' ' 65' ' ' GLY . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.510000000000005 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 74.439999999999998 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.400000000000006 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.595 ' N ' ' CD1' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.553 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 75.150000000000006 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 61.409999999999997 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.140000000000001 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.548 ' CG ' ' O ' ' A' ' 74' ' ' MET . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.329999999999998 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.430000000000007 110.86 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.483 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.219999999999999 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.530000000000001 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.319999999999993 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.421 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.120000000000005 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 55.210000000000001 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 74.530000000000001 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 74.219999999999999 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.319999999999993 110.849 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.503 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 73.400000000000006 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 71.319999999999993 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.635 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 75.040000000000006 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.469 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.140000000000001 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.468 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.579 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.49 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 73.5 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.628 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 74.439999999999998 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.562 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.526 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.450000000000003 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.488 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.010000000000005 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.569 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.479 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.439999999999998 110.859 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.984 0.421 . . . . 74.430000000000007 111.176 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.406 ' O ' ' SG ' ' A' ' 125' ' ' CYS . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 73.540000000000006 111.144 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.310000000000002 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.447 ' CG ' ' OD1' ' A' ' 102' ' ' ASN . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.439999999999998 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.51 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 72.310000000000002 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.559 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 72.329999999999998 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.559 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.150000000000006 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 71.230000000000004 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.562 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.515 ' O ' ' CG ' ' A' ' 137' ' ' MET . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.239999999999995 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 74.329999999999998 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.450000000000003 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.604 ' HA ' ' CG ' ' A' ' 141' ' ' HIS . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 74.299999999999997 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.129999999999995 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.486 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.049999999999997 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.430000000000007 110.922 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.483 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.340000000000003 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.604 ' CG ' ' HA ' ' A' ' 136' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.219999999999999 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 74.140000000000001 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 74.540000000000006 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.57 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.471 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.239999999999995 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.530000000000001 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.340000000000003 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 74.349999999999994 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 74.120000000000005 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.443 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.319999999999993 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.430000000000007 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.540000000000006 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.635 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 75.140000000000001 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 71.140000000000001 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.486 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.5 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.527 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.450000000000003 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.549 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 71.420000000000002 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 73.140000000000001 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.129999999999995 110.899 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.804 0.335 . . . . 72.109999999999999 110.888 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.319999999999993 110.928 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.564 HG21 ' CD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.519999999999996 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.92 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 71.540000000000006 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.475 ' HG ' ' N ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.475 ' N ' ' HG ' ' A' ' 15' ' ' LEU . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 71.549999999999997 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.400000000000006 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.502 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.329999999999998 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.559 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 71.340000000000003 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.87 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.647 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 74.299999999999997 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 53.340000000000003 111.082 179.998 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.962 0.411 . . . . 73.019999999999996 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 111.045 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.219999999999999 110.848 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.239999999999995 111.171 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.412 ' CB ' HD22 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 70.109999999999999 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.606 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.310000000000002 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.617 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.530000000000001 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.617 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 72.510000000000005 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.549999999999997 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.526 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.400000000000006 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.140000000000001 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.557 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.0 m-70 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.230000000000004 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 71.510000000000005 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.319999999999993 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.209999999999994 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.409999999999997 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 73.519999999999996 110.808 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.230000000000004 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.210000000000001 110.861 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.540000000000006 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.430000000000007 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.129999999999995 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.496 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 75.230000000000004 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.310000000000002 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.299999999999997 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.558 ' N ' ' CD1' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.554 ' CG2' ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.040000000000006 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 73.439999999999998 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.120000000000005 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.571 ' HE2' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.219999999999999 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.564 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.450000000000003 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 74.140000000000001 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.566 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 75.450000000000003 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.598 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.030000000000001 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 71.420000000000002 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 74.25 110.898 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.614 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.319999999999993 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 64.200000000000003 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.616 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 75.25 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 74.120000000000005 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.409999999999997 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.517 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 72.430000000000007 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.569 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 71.420000000000002 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.694 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 63.420000000000002 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.42 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.540000000000006 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.495 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 75.209999999999994 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.502 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.481 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.653 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.462 ' HB3' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.450000000000003 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.329999999999998 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.653 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 73.420000000000002 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.468 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.469 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.219999999999999 110.876 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.928 0.394 . . . . 61.350000000000001 111.134 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 111.113 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.409999999999997 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 65.310000000000002 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.54 ' HG ' ' N ' ' A' ' 126' ' ' CYS . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.230000000000004 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.54 ' N ' ' HG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 75.150000000000006 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 74.239999999999995 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.558 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.530000000000001 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.559 ' CG2' HG13 ' A' ' 20' ' ' ILE . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.439999999999998 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 63.200000000000003 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.462 ' CD2' ' HB3' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.564 ' CD2' HG21 ' A' ' 12' ' ' THR . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 71.150000000000006 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.564 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.140000000000001 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.443 ' CD1' ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.230000000000004 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.563 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 73.230000000000004 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.140000000000001 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.447 ' CZ ' ' CB ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.540000000000006 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.140000000000001 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.430000000000007 111.142 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.040000000000006 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.584 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 74.25 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.478 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 74.349999999999994 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.109999999999999 111.103 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.702 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 71.140000000000001 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.239999999999995 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.549999999999997 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.299999999999997 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 75.319999999999993 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.120000000000005 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.5 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.049999999999997 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.120000000000005 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.464 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.555 ' CD2' HG13 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.349999999999994 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.458 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.532 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.0 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.099999999999994 110.913 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.858 0.361 . . . . 74.510000000000005 110.927 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.510000000000005 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.453 ' CG2' HD12 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.530000000000001 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.200000000000003 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.415 ' C ' ' CD ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.129999999999995 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.469 ' C ' ' CD1' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.44 HD23 ' CB ' ' A' ' 132' ' ' LEU . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 74.230000000000004 110.819 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 73.109999999999999 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 72.450000000000003 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.533 ' CG2' ' CE ' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.120000000000005 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.030000000000001 110.92 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 111.12 179.965 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.947 0.403 . . . . 72.510000000000005 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.329999999999998 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 71.319999999999993 111.132 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.439999999999998 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.646 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 75.140000000000001 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.477 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.130000000000003 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.572 ' CG2' ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.646 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.519999999999996 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.040000000000006 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.495 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 75.340000000000003 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 75.409999999999997 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.7 m-70 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.319999999999993 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 75.349999999999994 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 72.510000000000005 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.519999999999996 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 53.329999999999998 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.239999999999995 110.875 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.140000000000001 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.010000000000005 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.485 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 71.0 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.571 HD13 ' CD1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.329999999999998 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 71.319999999999993 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.575 ' HA ' ' CD2' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 74.010000000000005 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.529 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.319999999999993 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.654 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.49 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 73.109999999999999 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.538 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.510000000000005 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.549999999999997 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.409999999999997 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.049999999999997 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.604 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.040000000000006 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.668 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 73.409999999999997 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.32 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.496 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.561 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.329999999999998 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 72.340000000000003 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.487 ' CE ' HD11 ' A' ' 78' ' ' LEU . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.310000000000002 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.49 HD21 ' CB ' ' A' ' 75' ' ' ALA . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 75.530000000000001 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.418 HD11 ' CD1' ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.019999999999996 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.468 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.519999999999996 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.654 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.555 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 73.430000000000007 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 71.030000000000001 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.478 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.599 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.129999999999995 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.539 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 72.230000000000004 110.863 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.491 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.927 0.394 . . . . 71.099999999999994 111.126 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.521 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.521 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.150000000000006 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.492 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 75.299999999999997 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.120000000000005 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.200000000000003 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.0 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.531 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.219999999999999 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.531 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.513 HD21 ' N ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.299999999999997 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.555 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.409999999999997 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.319999999999993 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.473 ' C ' ' OD1' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 72.120000000000005 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.552 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.409999999999997 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.453 HD12 ' CG2' ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 75.329999999999998 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.505 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 73.349999999999994 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.150000000000006 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 74.409999999999997 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.497 ' CD ' ' C ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.47 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.540000000000006 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 50.119999999999997 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.414 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.510000000000005 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.58 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.319999999999993 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.475 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.019999999999996 111.135 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.668 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 65.5 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.530000000000001 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 74.129999999999995 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 72.219999999999999 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.229999999999997 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.530000000000001 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.210000000000001 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.578 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.200000000000003 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.428 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 64.510000000000005 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.51 ' CD1' ' CD1' ' A' ' 154' ' ' PHE . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.420000000000002 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.010000000000005 110.874 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.76 0.314 . . . . 75.299999999999997 110.804 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.414 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.439 HG23 ' CD2' ' A' ' 133' ' ' TYR . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 74.25 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.109999999999999 110.874 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.536 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.319999999999993 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.701 ' O ' ' CD2' ' A' ' 19' ' ' TYR . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.455 ' HA ' ' CG1' ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.439999999999998 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.701 ' CD2' ' O ' ' A' ' 16' ' ' LEU . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 72.030000000000001 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.606 HD11 ' CE1' ' A' ' 19' ' ' TYR . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.430000000000007 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.200000000000003 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.129999999999995 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.150000000000006 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 54.509999999999998 111.131 179.917 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.908 0.385 . . . . 74.329999999999998 110.822 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.340000000000003 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.140000000000001 111.04 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.209999999999994 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.596 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.010000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.569 ' O ' ' N ' ' A' ' 46' ' ' THR . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.120000000000005 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.549999999999997 110.803 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.461 ' CG2' ' H ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 62.020000000000003 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.569 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.319999999999993 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 64.450000000000003 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.498 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.540000000000006 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.488 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 4.3 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 74.120000000000005 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.439999999999998 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.519999999999996 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 90.3 m-70 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.340000000000003 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 75.099999999999994 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 74.239999999999995 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.329999999999998 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.109999999999999 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 50.100000000000001 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.412 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 73.230000000000004 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.412 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 71.409999999999997 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 52.0 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.219999999999999 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.471 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.349999999999994 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 71.319999999999993 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.439 HD21 ' N ' ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 72.010000000000005 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.541 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.420000000000002 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 74.340000000000003 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.666 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.019999999999996 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.569 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.566 ' CG ' ' O ' ' A' ' 74' ' ' MET . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 74.239999999999995 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.531 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 75.0 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.58 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.911 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.475 ' HA ' ' CE1' ' A' ' 141' ' ' HIS . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.607 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 73.340000000000003 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.446 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.626 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.240000000000002 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.684 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.409999999999997 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.493 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 73.120000000000005 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.567 HD22 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.495 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 74.510000000000005 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.020000000000003 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.574 ' HG ' ' CE2' ' A' ' 19' ' ' TYR . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.513 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.340000000000003 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.666 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 72.140000000000001 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.474 ' CB ' ' OH ' ' A' ' 19' ' ' TYR . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 62.130000000000003 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 100' ' ' LEU . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.109999999999999 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.57 HD13 ' CD2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 73.219999999999999 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.459 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.120000000000005 110.854 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG2' ' CE1' ' A' ' 21' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.878 0.37 . . . . 75.230000000000004 111.167 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.518 ' N ' ' CG2' ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.109999999999999 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.310000000000002 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.548 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.129999999999995 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.532 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.548 ' CG2' ' O ' ' A' ' 125' ' ' CYS . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 65.019999999999996 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.917 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 93' ' ' LEU . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.439999999999998 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.517 ' O ' ' CB ' ' A' ' 137' ' ' MET . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.450000000000003 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.109999999999999 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.569 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.566 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 73.319999999999993 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.519999999999996 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.439999999999998 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.469 ' CB ' ' CZ ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 35.7 m-70 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.140000000000001 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 65.409999999999997 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.239999999999995 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.578 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 73.519999999999996 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.49 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 73.420000000000002 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.684 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.219999999999999 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 65.329999999999998 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.120000000000005 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.209999999999994 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.430000000000007 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.109999999999999 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.596 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 75.150000000000006 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 71.409999999999997 110.887 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.57 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 71.109999999999999 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.476 ' CB ' HD12 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.030000000000001 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 71.310000000000002 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 41' ' ' LEU . 4.5 t30 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 62.109999999999999 110.878 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.79 0.328 . . . . 71.140000000000001 110.84 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 74.25 110.951 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.340000000000003 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.549999999999997 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 129' ' ' VAL . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.120000000000005 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 73.019999999999996 110.896 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.569 ' CE1' HG22 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 73.430000000000007 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.454 HG22 ' CB ' ' A' ' 125' ' ' CYS . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.299999999999997 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.420000000000002 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.644 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.310000000000002 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.109999999999999 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 62.340000000000003 111.103 -179.952 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.895 0.378 . . . . 73.040000000000006 110.816 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 73.329999999999998 111.06 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.503 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 65.299999999999997 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.430000000000007 111.102 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.597 ' HG ' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.350000000000001 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 75.409999999999997 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 73.340000000000003 110.819 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.400000000000006 110.844 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.491 ' CG2' ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.624 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.439999999999998 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 74.319999999999993 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 73.299999999999997 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.531 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.340000000000003 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.626 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.4 m-70 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.209999999999994 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.200000000000003 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 65.010000000000005 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.626 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 52.509999999999998 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.647 ' CD1' ' CD2' ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 73.040000000000006 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 71.439999999999998 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.445 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.150000000000006 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.329999999999998 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.439999999999998 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.647 ' CD2' ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 74.310000000000002 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.572 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 75.319999999999993 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.592 ' HB3' ' CD2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 72.209999999999994 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.219999999999999 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.509 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.019999999999996 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.559 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.618 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.200000000000003 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.399999999999999 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.299999999999997 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.743 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 70.140000000000001 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 73.430000000000007 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.645 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.299999999999997 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.659 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.420000000000002 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.400000000000006 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.493 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.576 HD13 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.549999999999997 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.594 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.483 ' CE ' HD12 ' A' ' 78' ' ' LEU . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.519999999999996 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.94 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.568 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 74.299999999999997 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.478 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.616 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.129999999999995 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.535 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.329999999999998 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.523 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 74.230000000000004 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.616 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.48 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.516 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.961 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.875 0.369 . . . . 74.5 111.152 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.454 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' ' CG2' ' A' ' 122' ' ' THR . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 71.349999999999994 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.519999999999996 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.54 ' O ' ' CG1' ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 74.400000000000006 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 65.430000000000007 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 74.409999999999997 110.885 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.566 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.200000000000003 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.566 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.120000000000005 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 73.140000000000001 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.535 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.209999999999994 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.593 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 64.120000000000005 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 74.030000000000001 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.541 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.532 ' CD1' ' CH2' ' A' ' 151' ' ' TRP . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 75.099999999999994 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.593 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.129999999999995 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 70.150000000000006 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.329999999999998 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.465 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.120000000000005 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.9 m-70 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.140000000000001 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.329999999999998 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.617 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.481 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 74.430000000000007 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 74.140000000000001 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 72.200000000000003 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 74.519999999999996 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 73.420000000000002 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 73.340000000000003 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.597 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 74.030000000000001 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.477 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.340000000000003 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.445 ' CB ' HD11 ' A' ' 41' ' ' LEU . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.450000000000003 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 64.409999999999997 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.456 ' CA ' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.530000000000001 110.846 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 3.1 pt-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.887 0.375 . . . . 73.349999999999994 110.939 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.540000000000006 110.873 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.5 ' CG2' ' CD2' ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 74.230000000000004 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 75.310000000000002 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.547 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.469 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 73.530000000000001 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 65.510000000000005 110.845 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.609 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.530000000000001 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.529 HG13 ' CG2' ' A' ' 129' ' ' VAL . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 74.430000000000007 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 75.150000000000006 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.150000000000006 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.549999999999997 111.075 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.903 0.382 . . . . 73.420000000000002 110.82 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.499 ' CG1' ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 75.450000000000003 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.467 ' CG ' HD21 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 75.040000000000006 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.140000000000001 111.068 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' ND2' ' A' ' 160' ' ' ASN . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.602 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 65.409999999999997 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.623 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 72.049999999999997 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 64.230000000000004 110.947 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.540000000000006 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.551 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.623 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.430000000000007 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 73.420000000000002 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 74.040000000000006 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.476 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.109999999999999 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.019999999999996 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.527 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.120000000000005 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.2 m-70 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.140000000000001 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 75.439999999999998 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.239999999999995 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 75.030000000000001 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.039999999999999 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 74.450000000000003 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 60' ' ' PHE . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.239999999999995 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 74.219999999999999 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.450000000000003 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.129999999999995 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.476 ' HA ' ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.510000000000005 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.450000000000003 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.040000000000006 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.573 ' HG ' ' CE1' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 64.439999999999998 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.588 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.099999999999994 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.588 ' N ' ' CG1' ' A' ' 71' ' ' VAL . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.49 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.120000000000005 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.603 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 75.340000000000003 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.239999999999995 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.530000000000001 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 74' ' ' MET . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.514 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 71.129999999999995 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.583 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 74.319999999999993 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 73.319999999999993 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.299999999999997 110.874 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.605 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.519999999999996 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.310000000000002 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.609 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 72.200000000000003 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.409999999999997 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.682 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.479 ' CB ' HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 75.510000000000005 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.575 HD23 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 74.040000000000006 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 75.120000000000005 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.466 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.239999999999995 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.609 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 74.010000000000005 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.487 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.219999999999999 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.603 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.496 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 61.530000000000001 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.130000000000003 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.5 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.340000000000003 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.581 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.140000000000001 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.513 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.230000000000004 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.420000000000002 110.926 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.903 0.382 . . . . 72.200000000000003 111.124 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.419 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.400000000000006 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.419 ' N ' ' CG2' ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.468 ' HB3' ' CE ' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.030000000000001 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.506 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 70.400000000000006 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.569 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.569 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.510000000000005 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.57 ' CD1' HD21 ' A' ' 135' ' ' LEU . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.329999999999998 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.496 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.409999999999997 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.573 HD21 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.129999999999995 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' ' 134' ' ' ASN . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.5 ' CD2' ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.200000000000003 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.519 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.439999999999998 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.464 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.430000000000007 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 72.519999999999996 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.439999999999998 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.611 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.409999999999997 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.47 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.430000000000007 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.682 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 73.109999999999999 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 73.430000000000007 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.329999999999998 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.310000000000002 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 71.209999999999994 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.499 ' SG ' ' CG1' ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.200000000000003 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.329999999999998 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.420000000000002 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.75 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.349999999999994 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.435 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 73.219999999999999 110.899 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.815 0.34 . . . . 74.299999999999997 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 74.099999999999994 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.510000000000005 111.161 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.909 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.542 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.030000000000001 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.542 ' N ' ' HD3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 74.209999999999994 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 74.340000000000003 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 73.239999999999995 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.400000000000006 110.954 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.613 ' CE1' ' CD1' ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.340000000000003 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.613 ' CD1' ' CE1' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.530000000000001 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.565 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 73.319999999999993 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 73.340000000000003 111.088 -179.993 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.956 0.407 . . . . 71.310000000000002 110.811 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.040000000000006 111.156 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.499 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 73.140000000000001 111.072 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 72.25 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 64.219999999999999 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.862 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 46' ' ' THR . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.619 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 75.230000000000004 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 74.219999999999999 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.535 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 74.299999999999997 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.5 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.140000000000001 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.319999999999993 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 65.299999999999997 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.3 m-70 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 62.229999999999997 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.140000000000001 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.239999999999995 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 75.340000000000003 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 73.420000000000002 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.450000000000003 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.239999999999995 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 74.319999999999993 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 75.010000000000005 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.409999999999997 110.888 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.416 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 72.209999999999994 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.530000000000001 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.469 ' C ' ' O ' ' A' ' 66' ' ' ASN . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 73.150000000000006 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.471 ' N ' HD21 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.040000000000006 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 64.299999999999997 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.219999999999999 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.641 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 71.420000000000002 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.425 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 74.230000000000004 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.049999999999997 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.522 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.129999999999995 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.536 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.605 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.530000000000001 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.837 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.938 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.430000000000007 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.019999999999996 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.340000000000003 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.615 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.140000000000001 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 72.319999999999993 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.687 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.140000000000001 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 65.019999999999996 110.834 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.430000000000007 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.140000000000001 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.555 HG11 ' CE1' ' A' ' 154' ' ' PHE . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 74.340000000000003 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.483 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.474 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.571 ' HG ' ' CD2' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.489 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 71.430000000000007 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.641 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 75.129999999999995 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.452 ' CB ' HD23 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.039999999999999 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.340000000000003 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.507 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.030000000000001 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.544 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 73.230000000000004 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.469 ' C ' ' O ' ' A' ' 100' ' ' LEU . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.538 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.230000000000004 110.819 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.899 0.38 . . . . 75.540000000000006 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.434 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.329999999999998 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.434 ' N ' ' CG2' ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.099999999999994 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.49 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.329999999999998 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.526 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 72.319999999999993 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 70.129999999999995 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.57 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.57 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 72.109999999999999 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.569 HD21 ' N ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.519999999999996 110.888 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.473 ' HG ' ' CD1' ' A' ' 93' ' ' LEU . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.530000000000001 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 71.120000000000005 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.567 HD23 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.572 ' CD2' ' C ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.310000000000002 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.310000000000002 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 75.340000000000003 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.43 ' CG ' ' N ' ' A' ' 141' ' ' HIS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 73.019999999999996 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 40.1 m-70 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 72.329999999999998 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.46 ' HD3' ' C ' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 75.340000000000003 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 75.299999999999997 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 75.400000000000006 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.483 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.486 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 70.129999999999995 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.540000000000006 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 74.25 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.439999999999998 110.923 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.439999999999998 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.420000000000002 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.606 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.299999999999997 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.49 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.430000000000007 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.55 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.439999999999998 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.545 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 72.239999999999995 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.545 ' CE1' ' CD2' ' A' ' 157' ' ' PHE . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.430000000000007 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.329999999999998 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.444 ' CB ' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 62.32 110.846 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.783 0.325 . . . . 73.329999999999998 110.84 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.438 HG22 ' CD1' ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.430000000000007 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.010000000000005 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.485 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 73.409999999999997 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.429 ' CD2' ' HB3' ' A' ' 132' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 71.420000000000002 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 72.409999999999997 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.59 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 65.109999999999999 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.524 HG13 ' CG2' ' A' ' 129' ' ' VAL . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 74.140000000000001 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.219999999999999 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.310000000000002 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 64.530000000000001 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 74.349999999999994 111.066 -179.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.91 0.386 . . . . 73.239999999999995 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.512 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.129999999999995 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.310000000000002 111.143 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 72.049999999999997 111.084 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.584 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.520000000000003 110.903 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 60.520000000000003 110.84 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 46' ' ' THR . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.609 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.209999999999994 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.528 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 74.030000000000001 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.48 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.439999999999998 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 73.140000000000001 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.120000000000005 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.149999999999999 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.510000000000005 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.409999999999997 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.430000000000007 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 60.310000000000002 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 65.349999999999994 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 63.149999999999999 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.129999999999995 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.209999999999994 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.513 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.430000000000007 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 102' ' ' ASN . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.400000000000006 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.530000000000001 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.510000000000005 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.482 HD11 ' CE1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 73.409999999999997 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 72.109999999999999 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.239999999999995 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.657 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.109999999999999 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.299999999999997 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.528 ' CG ' HD22 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 73.120000000000005 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 75.400000000000006 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 74.439999999999998 110.877 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.030000000000001 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.583 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 73.409999999999997 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.621 ' O ' ' CD1' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.020000000000003 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.686 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 74.019999999999996 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 75.030000000000001 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.585 HD21 ' CE2' ' A' ' 85' ' ' PHE . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.140000000000001 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.643 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.426 ' O ' ' SD ' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.471 ' CD2' ' HB2' ' A' ' 75' ' ' ALA . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 74.109999999999999 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.59 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 64.310000000000002 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.497 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 70.219999999999999 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.657 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HB1' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 74.109999999999999 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.219999999999999 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.508 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.109999999999999 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.566 ' CD2' ' CE2' ' A' ' 96' ' ' PHE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.485 ' C ' ' O ' ' A' ' 100' ' ' LEU . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 50.140000000000001 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.539 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.319999999999993 110.911 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.933 0.397 . . . . 74.010000000000005 111.147 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.456 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 71.340000000000003 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.456 ' N ' ' CG2' ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.430000000000007 110.912 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.553 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.209999999999994 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.299999999999997 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 64.519999999999996 110.951 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.594 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.349999999999994 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.594 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.010000000000005 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.472 ' CD2' ' HB1' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 73.049999999999997 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' HD21 ' A' ' 134' ' ' ASN . 1.0 OUTLIER -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.554 ' CD1' ' CB ' ' A' ' 75' ' ' ALA . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.551 ' CD2' ' C ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.458 ' N ' HD11 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.219999999999999 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.310000000000002 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 75.200000000000003 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 74.349999999999994 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.140000000000001 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.421 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 73.400000000000006 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.59 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.129999999999995 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.209999999999994 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 75.349999999999994 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 74.430000000000007 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.477 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.430000000000007 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.420000000000002 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.010000000000005 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 72.430000000000007 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.643 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.405 ' SG ' ' O ' ' A' ' 152' ' ' ASP . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 64.25 110.914 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.56 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 72.109999999999999 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.489 ' CB ' HD11 ' A' ' 41' ' ' LEU . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 75.239999999999995 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.453 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 71.120000000000005 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.474 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.5 t-20 . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.299999999999997 110.885 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.827 0.346 . . . . 62.409999999999997 110.891 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.472 HG23 ' CD1' ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 64.230000000000004 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.540000000000006 110.902 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.557 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.230000000000004 110.937 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 70.239999999999995 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.540000000000006 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.629 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 73.549999999999997 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.539 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 74.010000000000005 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.906 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 41.329999999999998 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 75.230000000000004 111.09 179.975 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.927 0.394 . . . . 72.129999999999995 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.109999999999999 111.154 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.409999999999997 110.915 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.152 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.239999999999995 111.139 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.608 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.420000000000002 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' ' CD2' ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.209999999999994 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' H ' ' A' ' 46' ' ' THR . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.629 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 70.049999999999997 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.099999999999994 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.474 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.340000000000003 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 75.230000000000004 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.575 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.595 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.0 m-70 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.549999999999997 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.430000000000007 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.130000000000003 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.420000000000002 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.595 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.150000000000006 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.129999999999995 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.140000000000001 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 57' ' ' PHE . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.120000000000005 110.859 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.400000000000006 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.420000000000002 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.459 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.120000000000005 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.409999999999997 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.409999999999997 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.473 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 75.120000000000005 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.521 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 75.219999999999999 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 64.409999999999997 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.578 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.109999999999999 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 74.409999999999997 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.515 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.420000000000002 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.439999999999998 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.019999999999996 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.420000000000002 110.816 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.473 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.430000000000007 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.621 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 73.129999999999995 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.578 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.299999999999997 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.430000000000007 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.508 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.239999999999995 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.578 HD21 ' CE2' ' A' ' 85' ' ' PHE . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.676 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.48 ' CE ' HD11 ' A' ' 78' ' ' LEU . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.540000000000006 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.478 ' CG ' ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 63.210000000000001 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.230000000000004 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.602 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.120000000000005 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.452 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.209999999999994 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.420000000000002 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.509 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 74.549999999999997 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.602 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.474 ' HE3' ' CB ' ' A' ' 124' ' ' ASP . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.510000000000005 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.120000000000005 110.903 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.887 0.375 . . . . 74.439999999999998 111.093 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.434 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 73.129999999999995 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.434 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.409999999999997 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.474 ' CB ' ' HE3' ' A' ' 101' ' ' MET . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.527 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.530000000000001 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.219999999999999 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.575 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 75.420000000000002 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.575 ' N ' ' CD1' ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.510000000000005 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.319999999999993 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.478 ' HG ' ' CG ' ' A' ' 93' ' ' LEU . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.519999999999996 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.535 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 75.540000000000006 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.467 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 72.140000000000001 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 74.310000000000002 110.896 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.535 ' CD2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.200000000000003 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.25 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.489 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 74.340000000000003 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.473 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 73.049999999999997 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CE1' ' CD2' ' A' ' 85' ' ' PHE . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 65.519999999999996 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.583 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.299999999999997 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . 0.489 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 73.420000000000002 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.553 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 61.130000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.481 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.340000000000003 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 64.0 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.099999999999994 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.441 ' CH2' HD13 ' A' ' 136' ' ' LEU . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.510000000000005 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.448 ' C ' ' OD1' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.340000000000003 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 72.230000000000004 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.676 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.430000000000007 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 75.109999999999999 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.567 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.219999999999999 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.340000000000003 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.431 ' CE1' ' CD1' ' A' ' 154' ' ' PHE . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 72.120000000000005 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 72.129999999999995 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.432 ' N ' HD23 ' A' ' 41' ' ' LEU . 1.9 t30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 62.439999999999998 110.868 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.0 tm-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.874 0.369 . . . . 74.439999999999998 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.419 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.400000000000006 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.549999999999997 110.909 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.540000000000006 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.51 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.129999999999995 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.129999999999995 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.612 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.47 HD13 ' CG2' ' A' ' 128' ' ' ILE . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.400000000000006 110.907 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.466 ' HB1' ' CG ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 75.120000000000005 111.092 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.891 0.377 . . . . 50.140000000000001 110.844 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.450000000000003 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.209999999999994 111.065 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.219999999999999 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.609 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.130000000000003 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.535 ' O ' ' N ' ' A' ' 46' ' ' THR . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.019999999999996 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.530000000000001 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 41' ' ' LEU . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 71.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.612 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 70.329999999999998 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.540000000000006 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.473 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.099999999999994 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.219999999999999 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.522 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 74.109999999999999 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.59 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.6 m-70 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 75.319999999999993 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.59 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.549999999999997 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.409 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 43.049999999999997 110.863 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.120000000000005 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.340000000000003 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.319999999999993 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.310000000000002 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.530000000000001 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.518 ' N ' ' CD ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 72.439999999999998 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.049999999999997 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.47 ' N ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.519999999999996 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 74.450000000000003 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.299999999999997 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.576 ' HG3' ' CZ ' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.239999999999995 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.349999999999994 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.519 ' CD ' ' O ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.319999999999993 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.540000000000006 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.659 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.310000000000002 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.430000000000007 110.925 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 75.299999999999997 110.901 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.507 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.539999999999999 110.905 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.582 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 65.349999999999994 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.100000000000001 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.614 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 72.219999999999999 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 72.400000000000006 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.459 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.109999999999999 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.566 HG12 ' CE1' ' A' ' 154' ' ' PHE . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 64.519999999999996 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.474 ' CE ' HD11 ' A' ' 78' ' ' LEU . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.519999999999996 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.497 ' CD1' ' HB3' ' A' ' 132' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.52 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.329999999999998 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.464 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 72.420000000000002 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.636 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.109999999999999 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.514 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 75.530000000000001 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.469 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.129999999999995 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.489 HG21 ' N ' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.239999999999995 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.636 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 73.340000000000003 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.466 ' CG ' ' HB1' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.481 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.5 110.918 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 70.150000000000006 111.146 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 63.109999999999999 111.086 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.491 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.420000000000002 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.536 ' O ' ' CG1' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 73.310000000000002 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.451 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.409999999999997 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.407 ' CD1' ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 74.319999999999993 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.109999999999999 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 75.019999999999996 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 72.430000000000007 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.420000000000002 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.514 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.209999999999994 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.209999999999994 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.611 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.484 ' CD2' ' O ' ' A' ' 132' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.59 ' HG3' ' CE2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 141' ' ' HIS . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.040000000000006 112.504 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 110.863 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 74.430000000000007 110.942 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.611 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 74.120000000000005 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.239999999999995 111.152 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.120000000000005 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.476 HD11 ' C ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 71.430000000000007 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.329999999999998 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.109999999999999 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 62.310000000000002 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.340000000000003 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . 0.429 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 74.340000000000003 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.609 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 74.530000000000001 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.420000000000002 110.859 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . 0.564 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 74.340000000000003 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 63.009999999999998 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.5 ' CD1' ' CD1' ' A' ' 154' ' ' PHE . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.340000000000003 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.456 ' CA ' HD21 ' A' ' 41' ' ' LEU . 3.8 t30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 73.439999999999998 110.923 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.885 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' NH2' ' NH2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.439999999999998 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.530000000000001 111.099 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.099999999999994 110.899 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.040000000000006 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 74.439999999999998 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.483 ' N ' ' HG ' ' A' ' 15' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 71.310000000000002 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 63.32 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 71.019999999999996 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.567 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.120000000000005 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.503 HG13 ' CG2' ' A' ' 129' ' ' VAL . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 75.140000000000001 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.310000000000002 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.409999999999997 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 73.040000000000006 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 72.040000000000006 111.115 -179.996 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 110.921 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.154 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 61.310000000000002 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 64.140000000000001 111.135 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.517 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.634 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 75.209999999999994 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.010000000000005 110.848 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.556 HG13 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.634 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 74.540000000000006 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 73.430000000000007 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.491 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.109999999999999 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.219999999999999 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.219999999999999 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.602 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.2 m-70 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 72.239999999999995 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 73.340000000000003 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.602 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 74.099999999999994 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.401 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.340000000000003 110.882 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 64.230000000000004 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.329999999999998 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 65.420000000000002 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.530000000000001 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 75.239999999999995 110.803 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.120000000000005 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 74.150000000000006 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.472 ' NE ' ' HB3' ' A' ' 102' ' ' ASN . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 72.519999999999996 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 74.109999999999999 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.219999999999999 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.547 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 74.120000000000005 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.579 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 75.340000000000003 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.472 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.009999999999998 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 71.329999999999998 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.535 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 71.030000000000001 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.030000000000001 110.851 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.468 ' CD ' ' NH2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.609 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 71.319999999999993 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.319999999999993 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.349999999999994 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.699 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.200000000000003 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.209999999999994 110.874 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.511 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.230000000000004 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.59 HD21 ' CE2' ' A' ' 85' ' ' PHE . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 74.420000000000002 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.649 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.549999999999997 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.478 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 70.219999999999999 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.51 ' CG ' ' HG ' ' A' ' 132' ' ' LEU . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.502 ' CD2' ' HG ' ' A' ' 42' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 73.209999999999994 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 111.142 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 74.329999999999998 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.472 ' CB ' HD22 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.409999999999997 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 70.310000000000002 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.52 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.310000000000002 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.627 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.481 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.554 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.916 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.889 0.376 . . . . 74.049999999999997 111.105 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.414 HG23 ' N ' ' A' ' 123' ' ' ARG . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.349999999999994 111.153 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . 0.524 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . 0.539 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.432 ' CD2' ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.577 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.450000000000003 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.577 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.329999999999998 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 74.019999999999996 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.140000000000001 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . 0.51 ' HG ' ' CG ' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 75.010000000000005 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 72.430000000000007 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.523 HD22 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 72.540000000000006 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.556 ' CD2' ' C ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.340000000000003 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.507 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.299999999999997 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.009999999999998 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 74.420000000000002 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.468 ' NH2' ' CD ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.219999999999999 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.473 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 73.150000000000006 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.522 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.482 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.010000000000005 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.319999999999993 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' GLY . . . . . 0.482 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.109999999999999 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.400000000000006 110.951 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.310000000000002 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 61.149999999999999 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . 0.649 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.409999999999997 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.484 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.450000000000003 110.915 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' PHE . . . . . 0.556 ' CD2' HG13 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ASN . . . . . 0.51 ' OD1' ' N ' ' A' ' 41' ' ' LEU . 2.5 t30 . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 74.239999999999995 110.846 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.273 -1.131 . . . . 65.140000000000001 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -20.41 35.0 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.65 2.233 . . . . 75.140000000000001 112.374 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -114.07 -177.37 3.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 74.219999999999999 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.13 119.94 2.97 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.689 -0.767 . . . . 62.43 112.533 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.8 t -167.63 156.8 9.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 70.409999999999997 110.861 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -18.03 30.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 72.299999999999997 110.834 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.95 148.85 24.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 63.399999999999999 111.139 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.11 -66.75 0.9 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.322 -0.399 . . . . 62.219999999999999 110.859 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -104.08 -20.96 13.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.520000000000003 110.923 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -89.42 44.12 1.19 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.156 -0.475 . . . . 72.099999999999994 110.86 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.6 143.82 74.37 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.633 0.73 . . . . 75.310000000000002 110.864 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -91.0 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.696 2.264 . . . . 73.120000000000005 112.357 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 9' ' ' HIS . 7.6 mp -100.05 -5.15 28.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.428 ' CD2' ' OH ' ' A' ' 133' ' ' TYR . 20.2 t-80 -36.61 -71.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 73.349999999999994 110.868 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 -74.04 -8.31 55.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 75.230000000000004 110.926 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.404 ' CB ' ' HA ' ' A' ' 8' ' ' LEU . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 110.854 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.445 HG22 ' CD1' ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.420000000000002 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.512 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.349999999999994 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.639 ' CD1' ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.44 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 64.409999999999997 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.475 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.523 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 72.439999999999998 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 74.400000000000006 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 73.049999999999997 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.477 ' HB3' ' NE2' ' A' ' 103' ' ' GLN . . . -70.85 -8.95 56.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 72.140000000000001 111.118 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' CD ' ' HB3' ' A' ' 31' ' ' GLU . 34.2 ptt-85 -34.0 115.55 0.24 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.899 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.404 ' OE1' ' OE1' ' A' ' 111' ' ' GLN . 3.3 mt-10 -38.91 143.6 0.46 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.699 0.761 . . . . 74.109999999999999 110.814 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -4.69 14.55 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.317 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.66 6.76 14.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.231 -0.44 . . . . 74.519999999999996 110.856 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.411 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.2 t -150.89 127.9 5.43 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 72.420000000000002 111.101 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 150.37 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.717 2.278 . . . . 70.439999999999998 112.339 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HB3' ' CD ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.33 153.63 71.52 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.633 0.73 . . . . 72.219999999999999 110.888 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 170.17 17.26 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 73.540000000000006 112.326 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 170.72 15.91 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.62 2.213 . . . . 71.430000000000007 112.363 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 169.5 18.68 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.626 2.218 . . . . 73.400000000000006 112.402 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.421 HG21 ' NH2' ' A' ' 14' ' ' ARG . 1.4 m -106.72 -36.93 6.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.234 -0.439 . . . . 73.409999999999997 111.053 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.63 175.99 9.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 71.010000000000005 110.834 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 74.219999999999999 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.655 ' OE1' ' N ' ' A' ' 39' ' ' ALA . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.319999999999993 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 75.019999999999996 111.109 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.559 HD11 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.230000000000004 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' ' CD2' ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.430000000000007 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 63.210000000000001 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.453 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.219999999999999 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.619 ' CG2' ' N ' ' A' ' 46' ' ' THR . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.619 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 46' ' ' THR . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.209999999999994 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.497 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.519999999999996 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.463 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.540000000000006 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 75.8 m-70 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.209999999999994 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 73.530000000000001 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.230000000000004 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.239999999999995 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 74.25 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.349999999999994 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.400000000000006 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.439999999999998 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.329999999999998 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.310000000000002 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.140000000000001 110.952 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.409999999999997 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.140000000000001 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.466 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 74.230000000000004 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.210000000000001 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.607 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 71.349999999999994 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.522 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 72.299999999999997 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 75.430000000000007 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.239999999999995 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.484 ' CB ' HD22 ' A' ' 93' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 52.130000000000003 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.515 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 74.129999999999995 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.439999999999998 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.606 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.578 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 75.530000000000001 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.465 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.509999999999998 110.888 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.129999999999995 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 52.219999999999999 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.576 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 74.510000000000005 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.230000000000004 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.678 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.210000000000001 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.51 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.120000000000005 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.576 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.120000000000005 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.591 HG12 ' CZ ' ' A' ' 154' ' ' PHE . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.040000000000006 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.449 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 75.299999999999997 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.484 HD22 ' CB ' ' A' ' 75' ' ' ALA . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 75.299999999999997 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 75.140000000000001 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.445 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.340000000000003 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.649 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.319999999999993 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.537 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.120000000000005 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 74.019999999999996 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.340000000000003 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.567 ' CD2' ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.493 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 75.049999999999997 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -96.51 161.58 13.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 74.420000000000002 110.921 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.477 ' NE2' ' HB3' ' A' ' 24' ' ' ALA . 6.8 mp0 -128.56 161.53 29.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 71.109999999999999 110.853 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.547 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -161.22 46.71 0.38 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 74.329999999999998 112.546 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.3 Cg_endo -69.69 -162.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.709 2.273 . . . . 74.010000000000005 112.363 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.504 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.19 -70.89 0.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 74.340000000000003 110.905 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.516 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.91 72.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 73.140000000000001 110.93 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' A' ' 109' ' ' VAL . . . -62.3 -23.45 66.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 71.120000000000005 111.048 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.487 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 4.0 p -31.29 -45.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 73.219999999999999 111.13 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.487 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 2.5 mttm -90.56 82.59 5.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 74.349999999999994 110.882 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.404 ' OE1' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -88.74 95.06 10.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 71.549999999999997 110.868 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.84 -48.23 59.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 64.219999999999999 110.884 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.15 -162.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 74.109999999999999 110.857 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -94.38 -4.11 49.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 74.200000000000003 110.853 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.58 3.37 47.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 73.140000000000001 110.861 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -63.46 99.31 0.28 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.734 -0.746 . . . . 75.549999999999997 112.507 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -178.39 146.49 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 63.32 110.928 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.499 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 5.9 mmm180 -65.71 167.77 8.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 70.430000000000007 110.889 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.471 ' O ' ' CG2' ' A' ' 122' ' ' THR . 35.2 m -75.6 -12.47 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 73.450000000000003 111.129 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.481 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -53.41 -29.87 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 71.109999999999999 111.139 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -70.64 -47.73 62.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.467 . . . . 74.109999999999999 111.161 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.471 ' CG2' ' O ' ' A' ' 119' ' ' VAL . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.319999999999993 111.167 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.541 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 75.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.200000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.524 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.010000000000005 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.456 ' CD2' ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 73.430000000000007 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 75.430000000000007 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.1 t-20 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 75.340000000000003 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.239999999999995 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.537 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 63.520000000000003 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.349999999999994 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 73.319999999999993 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.547 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.200000000000003 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.457 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 43.32 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 74.540000000000006 110.907 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 71.420000000000002 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.578 ' CE1' ' O ' ' A' ' 80' ' ' SER . 6.6 m-70 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.010000000000005 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.049999999999997 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.135 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.48 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 74.219999999999999 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.458 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 53.039999999999999 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.150000000000006 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.678 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 75.109999999999999 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.209999999999994 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 71.109999999999999 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.450000000000003 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.239999999999995 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.591 ' CZ ' HG12 ' A' ' 91' ' ' VAL . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.450000000000003 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.48 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.520000000000003 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.540000000000006 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.463 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 71.329999999999998 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.481 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 6.9 t-20 -70.08 143.36 91.33 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 74.310000000000002 110.96 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -47.17 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.726 2.284 . . . . 75.109999999999999 112.311 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.481 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 3.7 mm? -66.24 150.67 96.73 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.572 0.701 . . . . 74.120000000000005 110.906 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 -37.81 8.51 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.698 2.265 . . . . 74.140000000000001 112.337 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -51.49 -174.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.89 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.315 -1.114 . . . . 71.329999999999998 110.315 179.912 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.426 ' O ' ' CD ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.295 -1.122 . . . . 74.209999999999994 110.295 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.406 ' C ' HD12 ' A' ' -3' ' ' LEU . 53.7 Cg_endo -69.71 -8.39 23.48 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.708 2.272 . . . . 72.409999999999997 112.315 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.474 ' CD2' ' CG ' ' A' ' 134' ' ' ASN . 7.3 mp -127.95 -175.45 3.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 74.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 111.14 152.37 12.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 62.0 112.507 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -120.17 140.96 50.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.829 0.347 . . . . 51.509999999999998 110.904 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt -57.56 -42.63 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 73.310000000000002 110.853 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -125.45 177.7 6.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 72.540000000000006 111.088 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -87.22 -55.64 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 75.510000000000005 110.93 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.6 t -127.94 -7.52 5.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.914 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -72.97 -7.82 52.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 74.120000000000005 110.927 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.479 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -107.57 86.99 3.11 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.654 0.74 . . . . 73.200000000000003 110.796 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.72 -0.23 6.58 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.753 2.302 . . . . 63.140000000000001 112.37 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.461 HD13 ' CD1' ' A' ' 151' ' ' TRP . 0.2 OUTLIER -89.02 -26.06 21.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 75.25 110.971 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.524 ' CE1' ' HG3' ' A' ' 10' ' ' GLU . 2.1 p-80 -77.04 -41.47 42.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 65.209999999999994 110.863 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.524 ' HG3' ' CE1' ' A' ' 9' ' ' HIS . 1.4 mt-10 -77.54 -22.1 51.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.906 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.465 HG21 ' CD1' ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 74.400000000000006 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.109999999999999 110.902 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.319999999999993 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.459 HD23 ' CG ' ' A' ' 38' ' ' GLU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 133' ' ' TYR . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 71.030000000000001 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.319999999999993 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.41 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.409999999999997 110.875 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.57 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.546 HG13 ' CG2' ' A' ' 129' ' ' VAL . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.010000000000005 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 64.120000000000005 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.613 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.340000000000003 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 62.32 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.581 ' CB ' ' NE2' ' A' ' 103' ' ' GLN . . . -81.98 17.14 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.329999999999998 111.117 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.427 ' O ' ' C ' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -110.38 112.7 24.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 74.420000000000002 110.859 -179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -35.54 153.67 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.586 0.708 . . . . 75.120000000000005 110.902 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.88 -10.19 27.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.695 2.263 . . . . 63.210000000000001 112.304 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -89.58 5.78 44.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 72.230000000000004 110.861 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 t -140.24 140.5 23.55 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-O 121.536 0.684 . . . . 74.409999999999997 111.153 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 136.73 33.72 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.647 2.231 . . . . 62.240000000000002 112.323 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.475 ' CB ' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -76.25 155.14 84.27 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.585 0.707 . . . . 73.040000000000006 110.893 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 169.9 17.87 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.682 2.254 . . . . 74.439999999999998 112.316 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 170.41 16.72 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.727 2.285 . . . . 74.340000000000003 112.268 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.69 -172.09 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.747 2.298 . . . . 73.219999999999999 112.319 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.41 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -130.16 -44.15 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 75.230000000000004 111.215 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -134.32 -178.38 5.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 73.319999999999993 110.835 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.450000000000003 111.084 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.484 ' OE1' ' CG ' ' A' ' 151' ' ' TRP . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 73.420000000000002 111.092 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.230000000000004 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.465 HD23 ' CG1' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.040000000000006 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.552 HD11 ' CB ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 74.049999999999997 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.519999999999996 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.438 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.340000000000003 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.631 ' CG2' ' N ' ' A' ' 46' ' ' THR . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 75.409999999999997 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.631 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 75.230000000000004 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.471 ' N ' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.502 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 75.040000000000006 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.502 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 65.530000000000001 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.109999999999999 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.430000000000007 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.61 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 74.310000000000002 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 73.430000000000007 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 74.030000000000001 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.61 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 73.430000000000007 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 74.099999999999994 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 71.040000000000006 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.230000000000004 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.299999999999997 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.434 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.240000000000002 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.409999999999997 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 75.230000000000004 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.529 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 74.510000000000005 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.508 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.420000000000002 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 75.420000000000002 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.200000000000003 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.040000000000006 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 73.140000000000001 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.219999999999999 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 75.109999999999999 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.665 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.519999999999996 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 65.099999999999994 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.129999999999995 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.340000000000003 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.557 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.209999999999994 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 75.420000000000002 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 110.894 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.409999999999997 110.923 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.586 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.450000000000003 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 65.310000000000002 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 74.230000000000004 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 73.310000000000002 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 75.239999999999995 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.350000000000001 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.150000000000006 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD12 ' CD2' ' A' ' 85' ' ' PHE . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.485 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 74.040000000000006 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.25 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.423 HD23 ' CB ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 74.230000000000004 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.57 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 74.230000000000004 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.436 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.409999999999997 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.665 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.439999999999998 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.541 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.57 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 72.430000000000007 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.51 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.140000000000001 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.51 ' CD2' HG23 ' A' ' 99' ' ' THR . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.481 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 73.209999999999994 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.515 ' ND2' ' CG1' ' A' ' 120' ' ' ILE . 0.3 OUTLIER -62.86 142.0 58.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.349999999999994 110.901 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.581 ' NE2' ' CB ' ' A' ' 24' ' ' ALA . 39.3 mm-40 -144.53 126.34 15.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 70.140000000000001 110.954 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.609 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.47 42.52 0.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 74.209999999999994 112.476 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.0 Cg_endo -69.79 -163.23 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.712 2.275 . . . . 74.540000000000006 112.375 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.9 t80 -124.31 -10.04 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 75.340000000000003 110.89 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.452 ' N ' ' HE1' ' A' ' 107' ' ' MET . 0.0 OUTLIER -36.9 96.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 110.889 179.93 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.448 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . . . -97.21 -152.09 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 71.219999999999999 111.059 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.585 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -66.33 -85.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.234 -0.439 . . . . 71.299999999999997 111.176 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.585 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 14.3 mttt -69.88 95.49 0.92 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 74.299999999999997 110.866 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 108' ' ' ALA . 19.0 mm-40 -142.93 166.32 24.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 110.913 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -154.72 159.63 40.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.192 -0.458 . . . . 71.430000000000007 110.951 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.453 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.2 OUTLIER 34.28 35.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.286 -0.416 . . . . 63.009999999999998 110.823 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 112' ' ' LYS . 6.6 m-20 -99.39 1.27 44.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 74.319999999999993 110.909 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.6 mt -45.87 -20.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 64.219999999999999 110.918 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . -76.72 59.55 3.39 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.814 -0.707 . . . . 72.219999999999999 112.462 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.464 ' ND2' HG11 ' A' ' 121' ' ' VAL . 12.7 p-10 -35.64 153.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.802 0.334 . . . . 75.400000000000006 110.903 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.497 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 6.7 mmt85 -40.86 162.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 75.120000000000005 110.823 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.474 HG11 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.4 -12.6 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 73.150000000000006 111.09 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.515 ' CG1' ' ND2' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -54.19 -30.18 20.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 72.439999999999998 111.155 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.497 ' CG1' ' O ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -70.55 -48.9 56.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 111.142 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.474 ' CG2' HG11 ' A' ' 119' ' ' VAL . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 75.140000000000001 111.087 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.414 ' N ' HG22 ' A' ' 122' ' ' THR . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 73.219999999999999 110.977 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.457 ' CB ' ' HE2' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.517 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.140000000000001 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.567 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.567 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 73.239999999999995 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.030000000000001 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.541 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.209999999999994 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.514 ' O ' ' CB ' ' A' ' 137' ' ' MET . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.409999999999997 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.474 ' CG ' ' CD2' ' A' ' -3' ' ' LEU . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 62.219999999999999 110.896 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.562 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.310000000000002 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.514 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.319999999999993 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.426 ' CD ' ' O ' ' A' ' -5' ' ' GLY . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.230000000000004 110.853 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.445 ' HG3' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 13.1 m-70 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 65.219999999999999 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.409999999999997 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 71.150000000000006 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 71.150000000000006 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.464 HD12 ' C ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.240000000000002 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.444 ' N ' HD12 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.140000000000001 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 73.430000000000007 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.140000000000001 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.329999999999998 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.099999999999994 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 61.329999999999998 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.485 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.409999999999997 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.464 ' SG ' ' N ' ' A' ' 156' ' ' ARG . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.109999999999999 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.340000000000003 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.532 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.239999999999995 110.954 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.4 OUTLIER -73.58 148.52 87.87 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 75.129999999999995 110.844 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -46.13 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.647 2.231 . . . . 71.540000000000006 112.343 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.483 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -59.33 159.51 15.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.704 0.764 . . . . 75.400000000000006 110.901 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -49.31 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.658 2.238 . . . . 70.430000000000007 112.321 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.433 ' O ' ' C ' ' A' ' 165' ' ' GLY . 1.8 mm? -51.6 -174.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 110.999 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.433 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.486 0 N-CA-C 110.27 -1.132 . . . . 74.430000000000007 110.27 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.524 0 N-CA-C 110.264 -1.134 . . . . 64.409999999999997 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.427 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.2 Cg_endo -69.79 -9.77 26.9 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.731 2.288 . . . . 72.540000000000006 112.309 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.427 ' C ' ' O ' ' A' ' -4' ' ' PRO . 8.8 tp -35.94 153.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 72.400000000000006 110.893 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 1' ' ' MET . . . -65.63 143.75 45.96 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.709 -0.758 . . . . 74.239999999999995 112.487 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 72.6 m -55.23 84.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 71.310000000000002 110.886 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.462 ' N ' ' O ' ' A' ' -2' ' ' GLY . 1.9 ptm -90.84 -53.67 4.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 71.109999999999999 110.869 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.4 177.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 65.549999999999997 111.114 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -113.45 -34.47 5.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 70.420000000000002 110.843 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.472 ' O ' ' CG ' ' A' ' 9' ' ' HIS . 52.4 p -80.49 6.05 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 110.812 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -83.39 -14.0 53.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 73.430000000000007 110.927 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -53.36 162.71 1.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.606 0.717 . . . . 64.099999999999994 110.891 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -48.79 0.65 Allowed 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.704 2.269 . . . . 74.030000000000001 112.408 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.473 HD12 ' N ' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -90.8 1.7 56.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.420000000000002 110.956 179.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.65 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 1.4 p80 -41.65 -54.15 3.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 63.299999999999997 110.852 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.65 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.2 tp10 -73.68 -19.06 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.310000000000002 110.868 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.439 ' NE ' ' HA ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 75.150000000000006 110.91 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.464 ' CG2' HD23 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.400000000000006 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 70.030000000000001 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.505 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 73.25 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.419 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 70.319999999999993 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.925 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.401 ' CG ' ' OG1' ' A' ' 35' ' ' THR . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.239999999999995 110.837 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 73.209999999999994 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.509 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.109999999999999 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.535 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.39 16.64 2.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 111.038 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.6 mmt-85 -114.63 112.74 23.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.894 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -53.01 162.59 1.0 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.596 0.712 . . . . 74.049999999999997 110.887 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -14.7 36.43 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.702 2.268 . . . . 71.409999999999997 112.356 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -94.95 5.63 51.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 63.340000000000003 110.867 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -136.05 140.98 34.74 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.652 0.739 . . . . 71.230000000000004 111.161 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 137.67 36.15 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.715 2.276 . . . . 62.409999999999997 112.341 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.535 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 1.0 OUTLIER -103.28 162.84 18.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.661 0.743 . . . . 75.109999999999999 110.852 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 160.73 48.61 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.705 2.27 . . . . 71.140000000000001 112.343 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 170.11 17.36 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.683 2.255 . . . . 64.120000000000005 112.311 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 152.8 69.01 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.716 2.277 . . . . 75.140000000000001 112.317 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.449 HG22 ' NE ' ' A' ' 14' ' ' ARG . 1.5 m -81.22 -55.71 4.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 73.439999999999998 111.141 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.1 t -152.59 178.21 9.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 71.319999999999993 110.859 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 111.106 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.469 ' CG ' HD21 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 74.329999999999998 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 74.299999999999997 111.115 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.589 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.510000000000005 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.657 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 71.510000000000005 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 74.230000000000004 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.46 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 73.530000000000001 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.528 ' CG2' ' N ' ' A' ' 46' ' ' THR . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 64.219999999999999 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.657 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 75.219999999999999 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 75.209999999999994 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.498 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 73.420000000000002 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.506 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 76.9 m-70 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.030000000000001 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.530000000000001 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.239999999999995 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.404 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.510000000000005 110.794 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.200000000000003 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.140000000000001 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 60.229999999999997 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 63.229999999999997 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.150000000000006 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.594 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.400000000000006 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.493 ' NE ' ' O ' ' A' ' 65' ' ' GLY . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 72.030000000000001 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 71.230000000000004 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 70.120000000000005 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.565 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.329999999999998 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.565 ' N ' ' CG1' ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 62.450000000000003 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 74.409999999999997 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.456 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 63.030000000000001 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 72.109999999999999 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 72.530000000000001 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.541 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 73.109999999999999 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.573 HD13 ' CD2' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 75.209999999999994 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 73.230000000000004 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 71.519999999999996 110.9 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 70.030000000000001 110.946 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 54.219999999999999 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.573 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 63.229999999999997 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.210000000000001 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.69 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 74.430000000000007 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 61.450000000000003 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 74.109999999999999 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.575 HD22 ' CE3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 72.239999999999995 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.329999999999998 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.465 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 75.409999999999997 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.486 ' C ' ' CD2' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.219999999999999 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.481 HD13 ' CD2' ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 75.040000000000006 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.475 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 73.430000000000007 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.652 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.409999999999997 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.47 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 62.149999999999999 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 61.109999999999999 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.494 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.399999999999999 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.555 HD12 ' CD2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 73.099999999999994 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.482 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 72.150000000000006 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.462 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -102.55 161.75 13.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.109999999999999 110.862 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.438 ' HA ' ' CG1' ' A' ' 120' ' ' ILE . 1.6 mm100 -133.72 -178.65 5.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 72.510000000000005 110.922 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 167.07 59.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.725 -0.75 . . . . 75.439999999999998 112.481 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.425 ' C ' ' HE1' ' A' ' 107' ' ' MET . 53.5 Cg_endo -69.78 -161.95 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 70.310000000000002 112.279 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.58 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.2 t80 -116.35 -9.11 11.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 74.0 110.94 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.572 ' N ' ' CE ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.31 90.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.067 -0.515 . . . . 75.129999999999995 110.864 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.549 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.03 -153.86 0.5 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 74.510000000000005 111.081 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.559 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -65.28 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 75.239999999999995 111.114 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.559 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 4.0 tttt -70.76 92.44 0.88 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 64.439999999999998 110.913 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -135.5 131.63 36.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 72.510000000000005 110.906 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -64.32 -76.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.019999999999996 110.908 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 -80.8 -178.38 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 75.409999999999997 110.789 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.51 -28.97 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 74.420000000000002 110.907 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.461 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.17 -13.08 1.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 64.340000000000003 110.868 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.458 ' N ' HD11 ' A' ' 115' ' ' LEU . . . -36.17 113.78 0.17 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.745 -0.74 . . . . 71.510000000000005 112.532 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.462 ' ND2' HG11 ' A' ' 121' ' ' VAL . 17.3 t30 -140.91 127.96 20.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 74.230000000000004 110.927 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 26.9 mmt-85 -69.93 164.22 24.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 74.209999999999994 110.896 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.472 HG21 ' CG2' ' A' ' 122' ' ' THR . 11.5 p -75.37 -13.66 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 111.173 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.438 ' CG1' ' HA ' ' A' ' 103' ' ' GLN . 0.1 OUTLIER -49.56 -22.87 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 73.239999999999995 111.076 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.462 HG11 ' ND2' ' A' ' 117' ' ' ASN . 7.7 p -76.44 -53.75 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 75.239999999999995 111.152 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.472 ' CG2' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.540000000000006 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 74.230000000000004 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.519999999999996 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.505 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 72.340000000000003 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 70.120000000000005 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.549 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.430000000000007 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.549 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 71.019999999999996 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 73.329999999999998 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.567 ' CD1' HD21 ' A' ' 135' ' ' LEU . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 132' ' ' LEU . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 63.210000000000001 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.489 ' O ' ' CB ' ' A' ' 137' ' ' MET . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.43 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 72.209999999999994 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.585 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.475 HD21 ' N ' ' A' ' 137' ' ' MET . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 71.409999999999997 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.489 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 72.129999999999995 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 74.25 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.329999999999998 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 75.239999999999995 110.845 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.099999999999994 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.507 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.140000000000001 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.549999999999997 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.209999999999994 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.619 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.420000000000002 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.474 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 74.319999999999993 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.319999999999993 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.69 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.010000000000005 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.474 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.310000000000002 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.408 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 65.219999999999999 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.020000000000003 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.340000000000003 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.494 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 62.509999999999998 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.581 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.040000000000006 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.419 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.409999999999997 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.471 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.209999999999994 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -48.85 150.11 2.81 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 71.349999999999994 110.912 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -47.87 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.679 2.252 . . . . 75.549999999999997 112.312 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.494 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 4.3 mm? -59.17 160.27 12.48 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.615 0.722 . . . . 72.430000000000007 110.865 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 -43.81 2.42 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.601 2.201 . . . . 75.450000000000003 112.407 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 mp -48.86 171.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 72.239999999999995 110.852 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.308 -1.117 . . . . 73.219999999999999 110.308 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.478 0 N-CA-C 110.288 -1.125 . . . . 40.100000000000001 110.288 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -49.33 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.707 2.272 . . . . 74.219999999999999 112.33 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -42.59 136.63 2.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 74.400000000000006 110.915 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' A' ' 0' ' ' SER . . . -149.45 -144.76 4.0 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.76 . . . . 63.140000000000001 112.476 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' -2' ' ' GLY . 0.7 OUTLIER -34.54 129.78 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.909 0.385 . . . . 65.430000000000007 110.851 -179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.514 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 2.4 ptp -84.25 -49.15 9.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 110.867 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.514 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -100.02 161.85 13.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 64.400000000000006 111.122 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -134.71 3.07 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.884 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -100.79 -19.31 16.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 71.030000000000001 110.862 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -93.54 46.44 1.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 73.420000000000002 110.944 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.517 ' HB3' ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -112.87 86.88 9.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.546 0.688 . . . . 53.240000000000002 110.844 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -90.85 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.65 2.233 . . . . 64.319999999999993 112.389 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 8' ' ' LEU . 10.4 mp -83.28 22.05 1.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.932 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.646 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 5.8 p-80 -61.89 -54.12 46.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.349999999999994 110.835 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.646 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 6.3 tt0 -79.58 -34.77 40.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 110.897 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.425 ' N ' ' CD ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.488 ' CG2' ' CD2' ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.329999999999998 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 74.239999999999995 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.546 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 71.430000000000007 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 75.299999999999997 110.958 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 75.430000000000007 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' CG ' ' CB ' ' A' ' 35' ' ' THR . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.209999999999994 110.912 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.585 ' CE1' HG22 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.510000000000005 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 129' ' ' VAL . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 74.409999999999997 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 73.329999999999998 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 73.150000000000006 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -82.54 4.95 22.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 73.239999999999995 111.067 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' C ' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -32.41 111.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.842 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -49.02 149.46 3.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.612 0.72 . . . . 70.530000000000001 110.938 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -10.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 75.150000000000006 112.318 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -109.23 5.87 24.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.873 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -153.22 141.17 13.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.568 0.699 . . . . 72.349999999999994 111.143 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.65 165.34 31.17 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.641 2.228 . . . . 62.530000000000001 112.386 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.37 141.86 80.86 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.719 . . . . 65.310000000000002 110.927 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 169.61 18.59 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.69 2.26 . . . . 60.32 112.323 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 170.25 16.94 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.719 2.279 . . . . 74.219999999999999 112.368 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 136.38 32.68 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.687 2.258 . . . . 75.319999999999993 112.301 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.531 ' CG2' ' N ' ' A' ' 36' ' ' SER . 0.6 OUTLIER -70.72 -44.68 66.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 64.200000000000003 111.176 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.531 ' N ' ' CG2' ' A' ' 35' ' ' THR . 2.1 m -142.04 -177.37 5.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 73.329999999999998 110.883 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.422 HG21 ' C ' ' A' ' 165' ' ' GLY . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.519999999999996 111.177 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.515 ' CD ' ' CD2' ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.010000000000005 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 111.108 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.569 HD12 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.340000000000003 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' THR . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.310000000000002 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 73.510000000000005 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.42 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.409999999999997 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.634 ' CG2' ' N ' ' A' ' 46' ' ' THR . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.040000000000006 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.634 ' N ' ' CG2' ' A' ' 45' ' ' VAL . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.519 ' N ' HG21 ' A' ' 46' ' ' THR . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.485 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.409999999999997 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.562 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.030000000000001 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.596 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.7 m-70 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 74.239999999999995 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.430000000000007 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.219999999999999 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.340000000000003 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.596 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.403 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.907 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.510000000000005 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.403 ' SG ' ' O ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 74.049999999999997 110.832 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 75.319999999999993 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 71.140000000000001 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.209999999999994 110.878 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.340000000000003 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 75.010000000000005 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.569 ' HE ' ' N ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 71.510000000000005 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.239999999999995 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 74.299999999999997 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.099999999999994 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.530000000000001 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.664 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 74.099999999999994 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.010000000000005 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.519 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 63.32 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.53 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.129999999999995 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.593 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.140000000000001 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.510000000000005 110.847 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.476 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 73.239999999999995 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.210000000000001 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 75.150000000000006 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.329999999999998 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.572 ' CD2' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 72.430000000000007 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 74.510000000000005 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.409999999999997 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.310000000000002 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.509 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 73.219999999999999 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.577 HD13 ' CE1' ' A' ' 141' ' ' HIS . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 74.409999999999997 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.63 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.040000000000006 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.424 ' HE3' ' C ' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.299999999999997 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.436 HD11 ' CD2' ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 75.109999999999999 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.522 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 74.420000000000002 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 75.010000000000005 111.126 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.664 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 74.239999999999995 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.545 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 73.340000000000003 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.439999999999998 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.605 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 74.329999999999998 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.451 ' HE2' ' CG2' ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 73.340000000000003 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -86.94 161.34 18.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.329999999999998 110.904 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.473 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 56.0 mm-40 -140.05 70.02 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 64.439999999999998 110.948 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.97 70.23 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.806 -0.712 . . . . 74.549999999999997 112.553 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.71 -162.71 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.692 2.261 . . . . 74.329999999999998 112.326 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.695 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.38 -83.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 73.150000000000006 110.944 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.541 ' HE2' ' CG ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -152.24 -157.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 73.230000000000004 110.883 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -140.82 108.25 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 65.310000000000002 111.134 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.474 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 13.0 p -156.14 -51.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 73.299999999999997 111.165 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.474 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 7.3 mttt -94.49 78.74 3.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 71.420000000000002 110.863 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -136.04 122.07 20.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 73.299999999999997 110.946 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 6.4 mmpt? -83.7 34.08 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.447 . . . . 75.310000000000002 110.919 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 75.530000000000001 110.904 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -108.12 -58.53 1.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 73.319999999999993 110.859 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.458 ' N ' HD11 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.63 -13.04 2.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 72.140000000000001 110.935 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.444 ' N ' HD13 ' A' ' 115' ' ' LEU . . . 70.65 -110.69 3.39 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.825 -0.702 . . . . 63.340000000000003 112.47 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -80.66 176.16 10.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 62.119999999999997 110.889 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.526 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.8 mmp_? -44.38 138.47 3.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 73.340000000000003 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.402 ' CG2' HD22 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -76.58 -11.41 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 63.409999999999997 111.131 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.545 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -66.74 -31.01 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 72.420000000000002 111.081 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.545 ' N ' ' CD1' ' A' ' 120' ' ' ILE . 0.5 OUTLIER -76.46 -42.11 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.109999999999999 111.158 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.439999999999998 111.149 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.319999999999993 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.541 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 62.350000000000001 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.58 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.58 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 75.140000000000001 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.530000000000001 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.120000000000005 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.545 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.540000000000006 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.496 ' CE1' ' O ' ' A' ' 9' ' ' HIS . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.540000000000006 110.926 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 73.120000000000005 110.904 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.578 HD22 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 74.420000000000002 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HA ' ' CE1' ' A' ' 141' ' ' HIS . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 73.230000000000004 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 110.912 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.430000000000007 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.439999999999998 110.9 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.59 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 74.430000000000007 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.475 ' O ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.409999999999997 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 74.549999999999997 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.420000000000002 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.478 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 63.439999999999998 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.459 ' N ' HD12 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.340000000000003 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 54.109999999999999 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 62.219999999999999 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' GLY . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.310000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 71.209999999999994 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.63 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 73.030000000000001 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 156' ' ' ARG . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.310000000000002 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.574 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.407 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 74.120000000000005 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.426 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.010000000000005 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -65.38 140.06 97.59 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 63.119999999999997 110.901 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.643 2.228 . . . . 72.120000000000005 112.385 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.02 141.36 96.55 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.643 0.735 . . . . 73.209999999999994 110.943 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -51.02 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.676 2.251 . . . . 72.519999999999996 112.281 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.7 mp -86.98 -173.31 4.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 74.120000000000005 110.946 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.422 ' C ' HG21 ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.31 -1.116 . . . . 53.439999999999998 110.31 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.56 0 N-CA-C 110.251 -1.139 . . . . 61.109999999999999 110.251 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 0.08 6.11 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.686 2.257 . . . . 74.319999999999993 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.432 ' CD2' ' NH2' ' A' ' 139' ' ' ARG . 5.8 tt -65.39 115.83 6.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 71.129999999999995 110.999 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -57.49 -158.13 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.777 -0.725 . . . . 75.209999999999994 112.516 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -107.82 134.95 50.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.959 0.409 . . . . 72.540000000000006 110.788 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 26.1 ptm -90.74 -52.83 4.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 73.329999999999998 110.896 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.482 ' CB ' ' CG ' ' A' ' 5' ' ' GLN . . . -133.8 178.53 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 73.010000000000005 111.087 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.9 -32.31 3.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -23.63 10.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 62.299999999999997 110.839 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.482 ' CG ' ' CB ' ' A' ' 2' ' ' ALA . 59.4 mm-40 -40.98 -40.09 1.33 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 73.420000000000002 110.872 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.04 86.76 9.56 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.547 0.689 . . . . 60.119999999999997 110.908 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.05 3.92 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.665 2.244 . . . . 73.439999999999998 112.321 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 151' ' ' TRP . 2.1 mt -66.72 -4.06 8.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 74.150000000000006 110.897 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -61.45 -77.04 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 72.430000000000007 110.93 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 -51.76 -16.62 0.71 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 61.039999999999999 110.844 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.472 ' CG2' HD22 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.430000000000007 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.5 110.925 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 73.230000000000004 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.239999999999995 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.456 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 110.874 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 71.299999999999997 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.545 HG13 ' CG2' ' A' ' 129' ' ' VAL . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 74.510000000000005 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.633 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.240000000000002 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.549999999999997 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.08 17.03 10.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 71.239999999999995 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -114.24 112.97 23.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.443 . . . . 73.439999999999998 110.883 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' ARG . 8.0 mt-10 -35.2 149.65 0.1 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.71 0.767 . . . . 74.129999999999995 110.901 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -20.38 35.08 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.622 2.214 . . . . 62.240000000000002 112.429 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -75.66 5.51 6.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 64.019999999999996 110.861 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 t -143.0 141.13 18.92 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.672 0.749 . . . . 64.340000000000003 111.104 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 137.33 35.19 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.715 2.277 . . . . 64.439999999999998 112.31 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.528 ' CD ' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -86.38 151.46 53.6 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.624 0.726 . . . . 65.239999999999995 110.882 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 170.38 16.74 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.64 2.227 . . . . 65.409999999999997 112.323 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 170.19 17.21 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.714 2.276 . . . . 75.230000000000004 112.283 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.437 ' HG3' ' CB ' ' A' ' 40' ' ' ALA . 53.4 Cg_endo -69.78 -174.48 0.92 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.713 2.275 . . . . 71.129999999999995 112.32 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.28 -36.54 4.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 54.399999999999999 111.177 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -133.88 -178.69 5.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 73.209999999999994 110.805 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 111.145 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.479 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.150000000000006 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.400000000000006 111.058 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.437 ' CB ' ' HG3' ' A' ' 34' ' ' PRO . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.130000000000003 111.12 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.589 ' HG ' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 70.209999999999994 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 73.439999999999998 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.89 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 71.150000000000006 110.922 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.491 ' CG2' ' N ' ' A' ' 46' ' ' THR . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 72.200000000000003 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.643 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.039999999999999 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.439999999999998 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.521 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 75.200000000000003 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.549999999999997 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.564 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.239999999999995 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.9 m-70 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.150000000000006 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.030000000000001 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.340000000000003 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 60.219999999999999 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 64.340000000000003 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 73.010000000000005 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 73.439999999999998 110.864 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 71.109999999999999 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.340000000000003 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.474 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 74.120000000000005 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 61.450000000000003 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.532 HD12 ' CE1' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.531 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 73.319999999999993 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.349999999999994 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.439999999999998 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.559 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 62.340000000000003 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.51 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.450000000000003 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.543 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 75.319999999999993 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.569 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 63.210000000000001 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.310000000000002 110.885 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.540000000000006 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 61.310000000000002 110.826 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.612 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 70.019999999999996 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.65 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 74.549999999999997 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.656 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.230000000000004 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 74.430000000000007 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.572 HD22 ' CD2' ' A' ' 85' ' ' PHE . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 72.310000000000002 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.59 HG11 ' CZ ' ' A' ' 154' ' ' PHE . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 73.019999999999996 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.456 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.483 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.519999999999996 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.46 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.649 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 75.420000000000002 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.546 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.400000000000006 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.140000000000001 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 75.510000000000005 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.598 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.319999999999993 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.498 ' HE2' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 72.150000000000006 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.511 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -97.0 161.21 13.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 72.430000000000007 110.971 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.49 ' OE1' ' CG ' ' A' ' 101' ' ' MET . 2.3 mm100 -129.39 106.41 8.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 72.25 110.894 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.504 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -151.92 49.51 0.53 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.765 -0.731 . . . . 51.109999999999999 112.465 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.504 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.2 Cg_endo -69.78 -162.94 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.697 2.265 . . . . 74.439999999999998 112.322 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.529 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -124.36 -13.57 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 74.409999999999997 110.859 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.439 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -39.13 95.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.040000000000006 110.863 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.48 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -100.15 -151.52 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 72.099999999999994 111.106 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.562 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.37 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 74.040000000000006 111.117 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.562 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 1.2 mtpt -68.44 90.79 0.38 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.19 -0.459 . . . . 71.140000000000001 110.919 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.48 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 21.3 mm-40 -143.09 119.16 10.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 72.140000000000001 110.931 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.76 65.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 75.0 110.913 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -119.07 173.84 6.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 75.120000000000005 110.922 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.18 -55.45 0.98 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.242 -0.435 . . . . 71.0 110.892 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.408 ' N ' HD23 ' A' ' 115' ' ' LEU . 0.4 OUTLIER -56.88 -65.25 0.65 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 64.519999999999996 110.952 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 138.37 -45.07 1.07 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.767 -0.73 . . . . 52.210000000000001 112.517 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -154.8 116.5 4.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 60.200000000000003 110.881 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.56 ' O ' ' CG2' ' A' ' 122' ' ' THR . 36.8 ptt85 -153.47 15.24 0.51 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 110.892 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.4 t -78.9 -68.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 61.520000000000003 111.158 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.563 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -85.25 -31.08 6.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 75.109999999999999 111.112 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.563 ' N ' ' CD1' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -64.54 -40.66 89.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 73.109999999999999 111.144 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.56 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 74.340000000000003 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.521 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.409999999999997 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.484 ' HA ' ' CD2' ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.129999999999995 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.536 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.040000000000006 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.565 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 70.030000000000001 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.566 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.566 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 74.430000000000007 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.030000000000001 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.546 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 74.450000000000003 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 129' ' ' VAL . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.559 ' CD1' ' CB ' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.472 HD22 ' CG2' ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.319999999999993 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.32 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.432 ' NH2' ' CD2' ' A' ' -3' ' ' LEU . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 75.340000000000003 110.892 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 73.230000000000004 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.547 ' NH1' ' CD1' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 72.349999999999994 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.547 ' CD1' ' NH1' ' A' ' 142' ' ' ARG . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.030000000000001 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.340000000000003 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.656 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.030000000000001 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.477 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 41.439999999999998 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.435 ' CD1' HD23 ' A' ' 8' ' ' LEU . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 65.019999999999996 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.099999999999994 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 74.120000000000005 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.59 ' CZ ' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.530000000000001 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.556 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.463 ' CB ' HD13 ' A' ' 41' ' ' LEU . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 71.109999999999999 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.471 ' CB ' HD23 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.27 167.48 0.19 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.140000000000001 110.933 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 -50.08 0.5 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.708 2.272 . . . . 72.209999999999994 112.297 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.403 ' O ' ' ND2' ' A' ' 160' ' ' ASN . 0.7 OUTLIER -105.72 118.49 55.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.608 0.718 . . . . 60.329999999999998 110.91 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.76 -38.25 8.04 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.268 . . . . 65.420000000000002 112.305 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.467 ' N ' HD23 ' A' ' 164' ' ' LEU . 0.3 OUTLIER -76.38 177.01 7.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 75.420000000000002 110.887 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.264 -1.134 . . . . 51.310000000000002 110.264 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.554 0 N-CA-C 110.259 -1.136 . . . . 73.150000000000006 110.259 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -20.16 35.29 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.666 2.244 . . . . 64.420000000000002 112.344 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -122.96 -14.83 7.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 74.239999999999995 110.886 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 115.32 -173.87 14.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.695 -0.764 . . . . 70.219999999999999 112.446 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.1 t -91.04 118.36 30.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 72.510000000000005 110.887 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.1 ttt -90.89 -46.15 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 73.310000000000002 110.886 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.7 176.71 6.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 72.540000000000006 111.121 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.4 -39.48 16.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.426 . . . . 73.239999999999995 110.921 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.9 m -81.38 14.9 2.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.833 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -84.18 63.17 7.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 61.009999999999998 110.957 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.97 159.96 1.68 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.581 0.705 . . . . 70.129999999999995 110.907 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -91.03 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.727 2.285 . . . . 74.200000000000003 112.407 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.552 HD13 ' CD1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -113.36 5.77 16.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 61.109999999999999 110.918 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.46 ' N ' HD23 ' A' ' 8' ' ' LEU . 40.2 t-80 -43.1 -79.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.881 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -62.19 -15.24 45.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.895 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.209999999999994 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.451 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 70.219999999999999 110.919 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.487 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.430000000000007 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.140000000000001 110.842 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.553 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.239999999999995 110.864 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.568 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 73.450000000000003 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.538 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 73.019999999999996 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.239999999999995 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.85 17.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.209999999999994 111.044 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' CA ' ' NE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -112.59 112.75 24.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 72.200000000000003 110.908 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -39.07 154.62 0.15 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.66 0.743 . . . . 73.099999999999994 110.877 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 -8.43 23.58 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.699 2.266 . . . . 64.209999999999994 112.38 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.12 5.63 49.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 72.450000000000003 110.817 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.83 140.8 16.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 75.439999999999998 111.096 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 137.84 36.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.717 2.278 . . . . 74.510000000000005 112.33 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.411 ' CB ' ' CD2' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -74.84 156.84 86.24 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.694 0.759 . . . . 71.030000000000001 110.892 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 170.11 17.29 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.699 2.266 . . . . 73.530000000000001 112.386 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 170.27 16.95 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.632 2.221 . . . . 72.439999999999998 112.341 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -167.58 0.24 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.633 2.222 . . . . 61.310000000000002 112.358 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.553 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -131.58 -53.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 71.140000000000001 111.078 -179.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -124.05 -176.25 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.275 -0.421 . . . . 45.5 110.875 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.428 HG12 ' CA ' ' A' ' 165' ' ' GLY . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.209999999999994 111.077 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.499 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.140000000000001 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 63.219999999999999 111.097 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.409999999999997 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.664 ' CD1' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.239999999999995 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.603 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.209999999999994 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.430000000000007 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.479 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.239999999999995 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.53 ' CG2' ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 73.209999999999994 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.603 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 75.319999999999993 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.48 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 74.230000000000004 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.149999999999999 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 72.340000000000003 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.329999999999998 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.329999999999998 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 75.299999999999997 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.140000000000001 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 72.140000000000001 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 71.540000000000006 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.439999999999998 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 72.230000000000004 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 63.420000000000002 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.439999999999998 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.435 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.329999999999998 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 73.299999999999997 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.459 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.430000000000007 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 110.923 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.544 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 73.420000000000002 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.569 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.120000000000005 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.019999999999996 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.554 ' CG ' ' O ' ' A' ' 74' ' ' MET . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 73.430000000000007 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.547 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.613 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 73.129999999999995 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.409999999999997 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 73.5 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 72.099999999999994 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.72 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 72.099999999999994 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.627 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 74.530000000000001 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.439999999999998 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.109999999999999 110.838 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.483 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.582 HD13 ' CZ3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.439999999999998 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.627 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.487 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.439 ' CG ' HD21 ' A' ' 132' ' ' LEU . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.519999999999996 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.501 ' CD2' ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.109999999999999 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.506 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.634 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.230000000000004 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.522 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.150000000000006 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.230000000000004 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.409999999999997 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.634 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 63.450000000000003 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.506 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 74.549999999999997 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.503 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -69.24 146.19 52.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 75.299999999999997 110.847 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.467 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 49.0 mm-40 -147.37 82.04 1.53 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 72.109999999999999 110.867 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.93 58.57 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.757 -0.735 . . . . 54.119999999999997 112.472 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.432 ' HB3' ' CG2' ' A' ' 120' ' ' ILE . 53.9 Cg_endo -69.74 -163.13 0.1 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.717 2.278 . . . . 72.040000000000006 112.322 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.617 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.36 -29.57 3.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 73.329999999999998 110.921 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.474 ' N ' ' HE2' ' A' ' 107' ' ' MET . 15.3 mmt -36.1 92.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.501 . . . . 72.040000000000006 110.885 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.518 ' O ' ' NE2' ' A' ' 111' ' ' GLN . . . -106.84 19.4 20.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.347 -0.388 . . . . 73.5 111.087 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.461 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 13.3 p -91.08 -52.07 10.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 71.129999999999995 111.11 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.461 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 1.3 mtpt -116.15 76.91 1.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 74.450000000000003 110.934 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 108' ' ' ALA . 0.0 OUTLIER -115.28 134.46 55.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 72.310000000000002 110.891 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -163.24 -177.27 5.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 62.409999999999997 110.921 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.9 43.36 2.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.310000000000002 110.888 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -133.74 -65.2 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 64.400000000000006 110.894 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.459 ' N ' HD11 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -60.81 -11.91 9.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 75.25 110.872 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.412 ' N ' HD13 ' A' ' 115' ' ' LEU . . . 61.52 150.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.732 -0.747 . . . . 62.109999999999999 112.503 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.403 ' O ' ' O ' ' A' ' 116' ' ' GLY . 0.6 OUTLIER -47.84 -98.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.82 0.343 . . . . 75.209999999999994 110.863 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.509 ' O ' ' CG2' ' A' ' 122' ' ' THR . 26.8 mtt180 62.91 5.9 1.99 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 72.329999999999998 110.877 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.434 ' CG1' ' H ' ' A' ' 120' ' ' ILE . 1.3 p -76.38 -66.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 111.143 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.443 HG13 ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -84.77 -34.18 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.219999999999999 111.125 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.471 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.51 -43.34 94.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 111.143 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 75.239999999999995 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.899 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.040000000000006 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.516 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 75.099999999999994 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.239999999999995 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 70.109999999999999 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.564 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.409999999999997 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.564 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 75.219999999999999 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.506 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 71.319999999999993 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.522 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.400000000000006 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.58 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 74.099999999999994 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.451 ' ND2' ' C ' ' A' ' 134' ' ' ASN . 0.4 OUTLIER -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.824 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.547 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 72.349999999999994 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.508 ' CD1' ' CZ2' ' A' ' 151' ' ' TRP . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.040000000000006 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.58 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.530000000000001 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.049999999999997 112.492 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.485 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.420000000000002 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.475 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 74.200000000000003 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.420000000000002 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . 0.485 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 64.129999999999995 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.485 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.448 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 71.439999999999998 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.239999999999995 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.430000000000007 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 73.120000000000005 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.438 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 73.319999999999993 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.552 ' CD1' HD13 ' A' ' 8' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.230000000000004 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.119999999999997 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.019999999999996 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.664 ' CZ ' ' CD1' ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.109999999999999 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.497 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.150000000000006 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.457 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.457 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.439999999999998 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 74.040000000000006 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 4.3 t-20 -65.57 143.15 98.56 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.510000000000005 110.918 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -46.01 1.35 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.672 2.248 . . . . 74.219999999999999 112.361 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.433 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 4.5 mp -64.2 161.03 44.18 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.638 0.732 . . . . 73.129999999999995 110.907 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 64.140000000000001 112.415 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.47 -174.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 75.120000000000005 110.95 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.428 ' CA ' HG12 ' A' ' 37' ' ' VAL . . . . . . . . 0 C--N 1.335 0.522 0 N-CA-C 110.287 -1.125 . . . . 73.0 110.287 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 N-CA-C 110.28 -1.128 . . . . 71.310000000000002 110.28 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -38.31 8.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.724 2.282 . . . . 62.100000000000001 112.304 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 0' ' ' SER . 9.5 mt -100.44 -64.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.430000000000007 110.855 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.445 ' C ' ' O ' ' A' ' -3' ' ' LEU . . . 34.53 -93.27 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.819 -0.705 . . . . 72.219999999999999 112.391 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' -3' ' ' LEU . 90.0 p -144.35 105.63 4.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 75.230000000000004 110.906 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 tpt -56.67 -35.64 68.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.299999999999997 110.902 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.15 171.69 17.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 54.329999999999998 111.086 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -74.15 3.7 6.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.834 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 6' ' ' ASP . 14.8 t -95.17 -8.1 37.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.540000000000006 110.848 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' SER . 28.2 mm-40 -36.48 -31.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 72.129999999999995 110.889 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.4 OUTLIER -105.46 91.04 4.47 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.574 0.702 . . . . 73.400000000000006 110.899 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.476 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.1 Cg_endo -69.76 -2.13 9.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.69 2.26 . . . . 73.439999999999998 112.339 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.8 -16.47 12.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.244 -0.435 . . . . 73.340000000000003 110.936 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.541 ' CE1' ' OH ' ' A' ' 133' ' ' TYR . 5.6 t60 -63.86 -76.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 61.509999999999998 110.851 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' CD ' ' O ' ' A' ' 10' ' ' GLU . 15.1 tm-20 -57.22 -12.71 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 110.917 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.210000000000001 110.874 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.463 ' CG2' HD12 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.537 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 74.120000000000005 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.459 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.519999999999996 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.430000000000007 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.563 ' CE1' HG22 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.329999999999998 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.533 HG13 ' CG2' ' A' ' 129' ' ' VAL . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 73.25 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.329999999999998 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.639 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.010000000000005 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.88 17.17 2.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.075 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 47.6 mmt-85 -111.9 112.66 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 73.030000000000001 110.922 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -37.68 155.6 0.1 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.62 0.724 . . . . 74.040000000000006 110.902 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -10.76 29.34 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.621 2.214 . . . . 63.219999999999999 112.389 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -90.42 5.57 46.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.254 -0.43 . . . . 75.310000000000002 110.864 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.54 141.18 18.48 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.52 0.676 . . . . 72.200000000000003 111.185 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 137.09 34.82 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.656 2.237 . . . . 64.129999999999995 112.37 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' OE1' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -79.88 157.62 73.8 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 70.239999999999995 110.868 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 169.29 19.27 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.721 2.281 . . . . 72.209999999999994 112.336 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 170.0 17.58 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.696 2.264 . . . . 72.530000000000001 112.358 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.09 39.61 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.797 2.331 . . . . 62.140000000000001 112.267 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -97.85 -44.58 6.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 74.519999999999996 111.18 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.3 m -137.93 -177.8 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 74.120000000000005 110.888 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 75.030000000000001 111.145 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.469 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 74.400000000000006 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.049999999999997 111.121 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB1' ' ND2' ' A' ' 160' ' ' ASN . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 63.310000000000002 111.157 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.631 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.412 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 74.040000000000006 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.502 ' CG2' ' N ' ' A' ' 46' ' ' THR . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 72.019999999999996 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.631 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.319999999999993 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.329999999999998 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.030000000000001 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.489 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.240000000000002 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.319999999999993 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.491 ' OE2' ' NE2' ' A' ' 48' ' ' GLN . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.349999999999994 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 73.310000000000002 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.010000000000005 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.310000000000002 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.130000000000003 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.099999999999994 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 73.319999999999993 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.409999999999997 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 74.310000000000002 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 57' ' ' PHE . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 72.319999999999993 110.886 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.219999999999999 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.549999999999997 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.310000000000002 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.319999999999993 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.497 ' CZ ' ' OD1' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.439999999999998 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.476 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.553 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 75.319999999999993 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.540000000000006 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.349999999999994 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.581 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.109999999999999 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.451 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 55.210000000000001 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.150000000000006 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.542 ' CG ' ' O ' ' A' ' 74' ' ' MET . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.537 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.409999999999997 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.594 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.319999999999993 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.468 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.340000000000003 110.838 -179.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.419 ' HA ' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 73.420000000000002 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.299999999999997 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 72.549999999999997 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.63 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.430000000000007 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.119999999999997 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.688 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.340000000000003 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.239999999999995 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.571 HD22 ' CE2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.450000000000003 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.691 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.5 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.430000000000007 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.474 HD13 ' CD1' ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.530000000000001 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.461 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 72.150000000000006 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.623 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.561 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.539 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.319999999999993 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 75.140000000000001 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.623 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 70.209999999999994 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.508 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 75.409999999999997 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -87.88 161.14 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.955 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 44.9 mm-40 -143.31 145.03 32.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 74.150000000000006 110.922 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.0 58.93 0.15 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.762 -0.732 . . . . 61.439999999999998 112.48 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.63 -163.31 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 72.349999999999994 112.32 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.0 OUTLIER -125.52 -76.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 75.030000000000001 110.9 -179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.559 ' N ' ' CG ' ' A' ' 106' ' ' TYR . 30.0 mmt -112.61 71.82 0.75 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 63.299999999999997 110.796 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.17 92.8 5.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 73.420000000000002 111.082 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.44 ' N ' ' NE2' ' A' ' 111' ' ' GLN . 7.5 p -146.69 -51.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 71.340000000000003 111.151 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.417 ' C ' ' HG3' ' A' ' 111' ' ' GLN . 0.1 OUTLIER -95.51 77.81 3.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 74.409999999999997 110.934 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.468 ' HA ' ' CD2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -136.16 71.63 1.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -101.17 93.7 5.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 65.209999999999994 110.854 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.44 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.7 OUTLIER 34.84 37.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 73.299999999999997 110.893 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.443 ' OD1' ' C ' ' A' ' 114' ' ' ASP . 4.2 t0 -113.08 -67.27 1.01 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 70.510000000000005 110.868 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.468 ' CD2' ' HA ' ' A' ' 111' ' ' GLN . 2.7 pt? -102.34 -36.18 8.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.25 110.915 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.463 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 50.58 101.88 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 75.299999999999997 112.433 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.463 ' C ' ' O ' ' A' ' 116' ' ' GLY . 6.8 p-10 -33.42 112.43 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 62.310000000000002 110.834 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.517 ' O ' ' CG2' ' A' ' 122' ' ' THR . 8.0 ptt180 -142.97 28.97 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.478 . . . . 72.519999999999996 110.867 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.407 ' O ' HG22 ' A' ' 122' ' ' THR . 41.9 t -77.61 -69.45 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.409999999999997 111.072 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.471 ' O ' ' CG ' ' A' ' 124' ' ' ASP . 0.2 OUTLIER -87.24 -40.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 74.200000000000003 111.143 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.5 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -51.0 -35.94 15.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 72.519999999999996 111.114 179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.518 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.019999999999996 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.129999999999995 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.529 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 75.219999999999999 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.230000000000004 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.349999999999994 110.902 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.551 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 75.030000000000001 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.551 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.030000000000001 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.349999999999994 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.561 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.219999999999999 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.541 ' OH ' ' CE1' ' A' ' 9' ' ' HIS . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 75.120000000000005 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 61.420000000000002 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 110.887 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.478 HD11 ' N ' ' A' ' 137' ' ' MET . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 75.340000000000003 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.478 ' N ' HD11 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.340000000000003 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 73.120000000000005 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.477 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.519999999999996 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.419 ' CD ' ' HA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 72.340000000000003 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.468 ' CE1' ' O ' ' A' ' 80' ' ' SER . 25.5 m-70 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 72.329999999999998 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . 0.477 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.129999999999995 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.539999999999999 110.791 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.532 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 71.140000000000001 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.465 ' N ' HD11 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 63.0 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 75.549999999999997 111.142 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.688 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 62.450000000000003 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 73.230000000000004 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 73.319999999999993 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.340000000000003 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.349999999999994 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 74.510000000000005 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.691 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 74.219999999999999 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 65.420000000000002 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.58 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 54.409999999999997 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.522 ' CD1' ' CD1' ' A' ' 154' ' ' PHE . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.439999999999998 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.515 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -50.78 152.85 3.24 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.209999999999994 110.842 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -49.8 0.53 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.605 2.203 . . . . 74.450000000000003 112.401 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.515 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -58.55 160.78 9.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.59 0.71 . . . . 75.200000000000003 110.969 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 -90.36 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.646 2.231 . . . . 71.200000000000003 112.331 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.419 ' O ' ' C ' ' A' ' 165' ' ' GLY . 1.7 mp -99.02 177.25 5.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 74.109999999999999 110.942 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.336 0.528 0 N-CA-C 110.295 -1.122 . . . . 64.109999999999999 110.295 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 110.308 -1.117 . . . . 61.119999999999997 110.308 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.6 Cg_endo -69.78 -11.63 31.2 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.738 2.292 . . . . 73.140000000000001 112.296 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.446 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.8 OUTLIER -34.39 102.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 72.349999999999994 110.872 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 174.07 170.93 37.96 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 74.340000000000003 112.467 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.4 p -166.91 133.06 2.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 63.100000000000001 110.855 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ptp -89.8 -48.16 7.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 73.230000000000004 110.83 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.61 156.07 20.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 70.129999999999995 111.137 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -111.91 -50.13 2.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 110.883 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 t -150.21 78.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 65.200000000000003 110.891 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.49 ' NE2' ' OD2' ' A' ' 6' ' ' ASP . 3.5 pm0 -105.56 -5.26 20.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 70.530000000000001 110.923 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.49 ' OD2' ' NE2' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -112.63 169.63 6.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.553 0.692 . . . . 75.010000000000005 110.896 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -166.76 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.709 2.273 . . . . 74.129999999999995 112.3 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.422 HD13 ' C ' ' A' ' 8' ' ' LEU . 2.7 pp -69.85 -16.96 63.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.099999999999994 110.971 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -60.76 -67.29 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 73.549999999999997 110.855 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -55.04 -22.54 16.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 75.129999999999995 110.948 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.818 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 74.439999999999998 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' NH1' ' CD1' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 75.230000000000004 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.481 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.481 ' N ' ' HD3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.471 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 72.409999999999997 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 110.842 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.423 ' CG ' HG23 ' A' ' 35' ' ' THR . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 34.240000000000002 110.825 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 74.400000000000006 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.538 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.219999999999999 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 75.540000000000006 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.638 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.448 ' CB ' HG23 ' A' ' 121' ' ' VAL . . . -82.08 17.14 1.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.119999999999997 111.097 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 7.2 mtp180 -113.35 114.7 27.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 73.150000000000006 110.933 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -33.14 149.31 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.66 0.743 . . . . 63.240000000000002 110.856 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.91 29.85 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.69 2.26 . . . . 74.349999999999994 112.386 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.1 5.62 32.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 110.844 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.3 t -139.47 140.54 25.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.653 0.739 . . . . 72.239999999999995 111.104 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 137.17 35.08 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.761 2.307 . . . . 73.120000000000005 112.341 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' CB ' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -80.88 157.22 71.9 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.632 0.73 . . . . 73.420000000000002 110.839 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 169.99 17.7 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.612 2.208 . . . . 72.030000000000001 112.338 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 170.21 17.07 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.677 2.251 . . . . 71.109999999999999 112.351 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 165.38 31.11 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.712 2.275 . . . . 75.310000000000002 112.382 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.463 HG21 ' CB ' ' A' ' 39' ' ' ALA . 0.4 OUTLIER -99.28 -46.43 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 74.049999999999997 111.139 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.28 -176.04 4.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 65.239999999999995 110.854 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.432 ' CG2' ' OXT' ' A' ' 165' ' ' GLY . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 75.099999999999994 111.197 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.507 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.109999999999999 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.463 ' CB ' HG21 ' A' ' 35' ' ' THR . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.200000000000003 111.124 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 61.140000000000001 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.573 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 73.340000000000003 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.549999999999997 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 73.450000000000003 110.875 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.515 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 74.099999999999994 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.609 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 55.409999999999997 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.524 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.478 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 75.400000000000006 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.019999999999996 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 62.43 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.571 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.602 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.8 m-70 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.549999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.019999999999996 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.609 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.450000000000003 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.119999999999997 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 64.019999999999996 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.752 ' CE1' ' CD2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.109999999999999 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.530000000000001 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.019999999999996 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 44.329999999999998 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.329999999999998 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.476 ' CZ ' ' OD1' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.752 ' CD2' ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.52 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.219999999999999 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.676 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 73.219999999999999 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.467 ' HB2' ' CD2' ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 71.219999999999999 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.409999999999997 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.55 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 75.450000000000003 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.59 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.510000000000005 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.476 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.420000000000002 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.532 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.340000000000003 110.861 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.319999999999993 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.319999999999993 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 74.420000000000002 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 73.239999999999995 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.514 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.564 HD23 ' CE2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 74.150000000000006 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.57 HG12 ' CZ ' ' A' ' 154' ' ' PHE . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.467 ' CD2' ' HB2' ' A' ' 75' ' ' ALA . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.420000000000002 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.481 ' CD1' ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.319999999999993 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.426 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 74.239999999999995 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.676 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.566 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 72.519999999999996 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.239999999999995 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.509 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.519999999999996 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.509 ' CD2' HG21 ' A' ' 99' ' ' THR . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 74.010000000000005 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.478 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.239999999999995 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -80.4 158.07 26.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.310000000000002 110.882 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.496 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 13.3 mm-40 -152.56 130.4 11.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 65.219999999999999 110.956 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.539 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -156.38 46.8 0.5 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 73.109999999999999 112.499 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.1 Cg_endo -69.8 -163.69 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.64 2.227 . . . . 63.229999999999997 112.328 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.484 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -124.77 -68.12 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 74.349999999999994 110.901 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.535 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.25 73.62 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 55.219999999999999 110.869 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.77 76.52 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 63.439999999999998 111.123 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.498 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 7.3 p -137.25 -50.55 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 64.299999999999997 111.095 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.498 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 2.1 mtmt -97.68 77.07 2.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.916 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -134.4 147.41 50.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 63.25 110.902 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.416 ' CE ' ' HB3' ' A' ' 114' ' ' ASP . 19.8 ttpt -64.29 -6.27 6.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 65.109999999999999 110.914 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 41.59 40.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 73.400000000000006 110.912 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.416 ' HB3' ' CE ' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -100.92 -63.82 1.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.891 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 116' ' ' GLY . 0.1 OUTLIER -62.72 -8.45 6.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 73.530000000000001 110.931 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.427 ' N ' HD11 ' A' ' 115' ' ' LEU . . . 137.16 -141.14 12.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.737 -0.744 . . . . 63.340000000000003 112.492 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -103.02 -38.06 7.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.807 0.337 . . . . 72.510000000000005 110.89 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.467 ' NE ' ' HB3' ' A' ' 105' ' ' PRO . 18.3 mmm180 -154.61 176.13 12.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.867 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 122' ' ' THR . 9.1 p -78.76 -49.33 20.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 71.420000000000002 111.154 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.429 ' CG1' ' NE2' ' A' ' 103' ' ' GLN . 0.2 OUTLIER -62.81 -36.38 75.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 73.019999999999996 111.109 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.496 ' HB ' ' NE2' ' A' ' 103' ' ' GLN . 6.7 p -68.2 -54.29 23.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.200000000000003 111.114 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.456 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.120000000000005 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.140000000000001 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.446 ' OD1' ' CG ' ' A' ' 67' ' ' ARG . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.498 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.420000000000002 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.51 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 63.399999999999999 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.55 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 65.120000000000005 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.55 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.472 ' ND2' ' C ' ' A' ' 130' ' ' ASN . 0.3 OUTLIER -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.439999999999998 110.911 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.566 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 74.319999999999993 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.57 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.349999999999994 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.340000000000003 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.299999999999997 110.93 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.463 HD13 ' CZ2' ' A' ' 151' ' ' TRP . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.57 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.210000000000001 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.400000000000006 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.476 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 74.319999999999993 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 74.140000000000001 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 72.299999999999997 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 73.439999999999998 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 73.420000000000002 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.535 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 74.450000000000003 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.472 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.099999999999994 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.030000000000001 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.450000000000003 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.409999999999997 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.463 ' CZ2' HD13 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.239999999999995 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.530000000000001 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 70.209999999999994 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.573 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.319999999999993 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 71.340000000000003 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.562 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.409999999999997 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 74.409999999999997 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.588 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 75.109999999999999 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 75.519999999999996 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.487 ' CB ' HD21 ' A' ' 41' ' ' LEU . 2.1 t30 -53.48 139.88 47.51 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 72.319999999999993 110.888 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -46.4 1.21 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.727 2.285 . . . . 71.230000000000004 112.324 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.25 136.81 31.4 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.57 0.7 . . . . 75.310000000000002 110.89 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.81 -51.28 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.642 2.228 . . . . 63.149999999999999 112.343 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.474 ' N ' HD23 ' A' ' 164' ' ' LEU . 0.3 OUTLIER -85.06 -168.36 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 72.239999999999995 110.946 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.432 ' OXT' ' CG2' ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 75.219999999999999 110.27 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.289 -1.124 . . . . 40.100000000000001 110.289 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.48 ' O ' ' C ' ' A' ' -3' ' ' LEU . 54.5 Cg_endo -69.8 -52.02 0.35 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.669 2.246 . . . . 74.439999999999998 112.343 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.48 ' C ' ' O ' ' A' ' -4' ' ' PRO . 5.3 tp 31.63 53.36 0.23 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 71.140000000000001 110.914 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 167.2 159.79 13.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 54.219999999999999 112.448 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.5 m -171.94 121.79 0.48 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.816 0.341 . . . . 70.140000000000001 110.836 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.64 -39.97 12.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 75.030000000000001 110.91 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -123.97 164.65 18.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 71.430000000000007 111.067 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -126.38 -65.76 0.96 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 71.140000000000001 110.9 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 t -137.77 94.77 2.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.230000000000004 110.871 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -64.67 -43.82 92.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 71.310000000000002 110.914 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -86.82 156.39 55.5 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.6 0.714 . . . . 71.5 110.859 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -38.28 8.05 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.725 2.283 . . . . 74.129999999999995 112.368 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.553 ' C ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -104.7 6.85 34.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 75.349999999999994 110.97 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.649 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 4.8 t60 -54.61 -72.76 0.06 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.135 -0.484 . . . . 74.019999999999996 110.87 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.649 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 81.5 tt0 -59.74 -14.91 16.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 72.120000000000005 110.861 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.310000000000002 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.425 HG22 ' CD2' ' A' ' 133' ' ' TYR . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.040000000000006 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 75.319999999999993 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 62.32 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.457 ' CD1' HD21 ' A' ' 94' ' ' LEU . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.109999999999999 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.430000000000007 110.868 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.415 ' CG ' HG23 ' A' ' 35' ' ' THR . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 74.340000000000003 110.845 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.512 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 75.400000000000006 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.515 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 73.400000000000006 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.510000000000005 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.120000000000005 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.86 17.08 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.409999999999997 111.121 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.468 ' NE ' ' HD3' ' A' ' 32' ' ' PRO . 40.8 mtt85 -113.59 112.69 23.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 74.019999999999996 110.808 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 25' ' ' ARG . 9.1 mt-10 -37.9 153.76 0.13 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.639 0.733 . . . . 70.439999999999998 110.862 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 -9.66 26.67 Favored 'Trans proline' 0 C--O 1.231 0.126 0 C-N-CA 122.709 2.272 . . . . 72.409999999999997 112.335 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -89.74 5.51 45.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 74.530000000000001 110.907 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 t -139.02 139.16 22.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.554 0.692 . . . . 72.409999999999997 111.141 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 136.18 32.35 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.73 2.287 . . . . 73.549999999999997 112.326 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 0.7 OUTLIER -83.38 156.32 65.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.674 0.749 . . . . 65.209999999999994 110.885 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.468 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.5 Cg_endo -69.74 167.61 23.91 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 75.219999999999999 112.283 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 170.1 17.37 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.763 2.309 . . . . 71.510000000000005 112.352 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 178.89 4.06 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.711 2.274 . . . . 74.219999999999999 112.361 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.415 HG23 ' CG ' ' A' ' 18' ' ' ASP . 0.6 OUTLIER -116.84 -43.01 2.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 71.409999999999997 111.132 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.3 p -136.44 -174.94 3.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 65.310000000000002 110.917 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 73.049999999999997 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.543 ' OE1' ' CG ' ' A' ' 151' ' ' TRP . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.420000000000002 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 111.073 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.219999999999999 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.554 HD11 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.508 HD13 ' CB ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.219999999999999 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.340000000000003 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.485 ' CG2' ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.503 ' CB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.439999999999998 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.496 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.450000000000003 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.482 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.329999999999998 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 74.519999999999996 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.299999999999997 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 65.129999999999995 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.3 m-70 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.409999999999997 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 62.439999999999998 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 70.310000000000002 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 75.319999999999993 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.109999999999999 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 75.549999999999997 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.420000000000002 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 74.430000000000007 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.030000000000001 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.552 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.209999999999994 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.508 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 70.430000000000007 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.539 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 74.349999999999994 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 75.540000000000006 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 72.299999999999997 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.576 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.56 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 65.010000000000005 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.230000000000004 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.51 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 60.420000000000002 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.518 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.530000000000001 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.604 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 72.209999999999994 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.768 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.41 ' HA ' ' NE2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.340000000000003 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.83 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.599 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 63.539999999999999 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.569 ' CE2' HD11 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.150000000000006 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.439999999999998 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 75.219999999999999 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 75.409999999999997 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 63.32 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 74.150000000000006 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.503 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.433 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.120000000000005 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.508 ' CB ' HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.129999999999995 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.491 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 65.340000000000003 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.420000000000002 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.512 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.530000000000001 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.49 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.409999999999997 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.599 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 55.229999999999997 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 75.530000000000001 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -70.07 145.75 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.439999999999998 110.948 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.451 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 38.0 mm-40 -138.53 111.55 7.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 74.319999999999993 110.884 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -173.72 54.01 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 75.099999999999994 112.506 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.83 -163.04 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.679 2.253 . . . . 74.349999999999994 112.329 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.55 -77.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 63.439999999999998 110.989 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.538 ' SD ' ' C ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -162.28 158.5 24.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 74.349999999999994 110.917 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 107' ' ' MET . . . -124.47 -174.25 2.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 111.069 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.6 -52.93 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 73.120000000000005 111.091 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.73 78.99 4.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.209999999999994 110.833 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.416 ' OE1' ' CA ' ' A' ' 116' ' ' GLY . 24.6 mm-40 -141.77 155.2 45.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 71.230000000000004 110.867 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -65.6 -69.39 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 72.5 110.846 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -134.03 -89.05 0.38 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 74.510000000000005 110.862 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -119.22 -14.47 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 60.109999999999999 110.791 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.463 HD13 ' N ' ' A' ' 116' ' ' GLY . 0.1 OUTLIER -58.13 -11.78 2.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.0 110.907 -179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.463 ' N ' HD13 ' A' ' 115' ' ' LEU . . . -78.19 64.45 3.45 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.769 -0.729 . . . . 74.420000000000002 112.457 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.526 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.1 t30 -130.68 4.2 4.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.815 0.341 . . . . 74.319999999999993 110.9 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.53 ' O ' ' CG2' ' A' ' 122' ' ' THR . 4.5 ppt_? -76.67 34.64 0.14 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 64.200000000000003 110.85 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.457 ' H ' ' C ' ' A' ' 117' ' ' ASN . 96.6 t -79.51 -69.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.1 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.57 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -87.22 -33.11 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 73.219999999999999 111.155 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.57 ' N ' ' CD1' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -62.55 -41.55 92.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 74.409999999999997 111.121 179.836 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.539 ' CG2' ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.120000000000005 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.539 ' N ' ' CG2' ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.310000000000002 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.878 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.514 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.219999999999999 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.439999999999998 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.559 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 75.140000000000001 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.559 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 72.010000000000005 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.476 ' HB3' ' CD1' ' A' ' 93' ' ' LEU . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 75.129999999999995 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.492 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.409999999999997 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 71.319999999999993 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.56 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.329999999999998 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.492 ' CD2' ' O ' ' A' ' 133' ' ' TYR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.905 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.319999999999993 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.450000000000003 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.299999999999997 110.826 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 64.400000000000006 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.409999999999997 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.483 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.530000000000001 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.48 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.239999999999995 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.439999999999998 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.48 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.200000000000003 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.239999999999995 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.509999999999998 112.494 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.340000000000003 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.432 ' HA ' ' CD1' ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 71.310000000000002 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.409999999999997 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.431 ' CD1' ' HD1' ' A' ' 157' ' ' PHE . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.219999999999999 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 71.040000000000006 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.5 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -49.04 147.22 5.01 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 73.409999999999997 110.9 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.83 -37.63 8.74 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.677 2.251 . . . . 71.010000000000005 112.349 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.5 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 2.6 mt -64.09 154.11 83.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.656 0.741 . . . . 73.099999999999994 110.891 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.79 -34.18 14.99 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 74.430000000000007 112.357 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.89 167.61 5.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 64.209999999999994 110.887 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.287 -1.125 . . . . 73.540000000000006 110.287 179.926 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.424 ' HA3' ' CZ ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.233 -1.147 . . . . 43.210000000000001 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' -2' ' ' GLY . 54.0 Cg_endo -69.77 -48.57 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.688 2.258 . . . . 70.030000000000001 112.358 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' -4' ' ' PRO . 4.1 mm? -37.84 93.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 74.329999999999998 110.93 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 61.55 75.91 0.27 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.834 -0.698 . . . . 54.439999999999998 112.474 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.8 m -48.31 175.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 70.329999999999998 110.883 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -15.81 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 72.310000000000002 110.844 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.83 177.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.425 . . . . 75.5 111.089 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -116.53 -10.41 11.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 61.140000000000001 110.885 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.5 p -122.8 -19.83 6.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 73.519999999999996 110.893 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -80.34 4.32 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 72.420000000000002 110.894 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -106.62 86.84 2.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.622 0.725 . . . . 75.109999999999999 110.839 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -16.08 37.5 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.7 2.267 . . . . 73.519999999999996 112.318 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.55 21.97 15.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.271 -0.422 . . . . 65.109999999999999 110.93 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -69.54 -71.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.9 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.48 -23.1 66.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.459 . . . . 71.209999999999994 110.844 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.455 ' CG2' HD13 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 72.310000000000002 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.806 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.47 ' NE ' HG23 ' A' ' 35' ' ' THR . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 73.150000000000006 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.509 ' CD1' ' C ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 110.93 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 75.349999999999994 110.815 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.439999999999998 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.510000000000005 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.521 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.409999999999997 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 74.319999999999993 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.349999999999994 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -70.9 -13.28 61.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.135 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.471 ' CB ' ' HB3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -33.39 111.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 74.25 110.908 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -54.39 151.21 14.36 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 121.642 0.734 . . . . 72.409999999999997 110.902 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -10.06 27.6 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.647 2.231 . . . . 64.129999999999995 112.308 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -109.34 5.71 23.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 65.329999999999998 110.773 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -145.7 141.32 16.68 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.596 0.712 . . . . 75.340000000000003 111.087 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 137.38 35.19 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.68 2.253 . . . . 75.209999999999994 112.38 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.4 152.81 95.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.619 0.724 . . . . 72.530000000000001 110.93 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.86 170.17 17.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.587 2.192 . . . . 71.140000000000001 112.356 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 170.61 16.1 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.711 2.274 . . . . 63.119999999999997 112.308 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -179.44 2.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.635 2.223 . . . . 73.230000000000004 112.368 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.47 HG23 ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -108.53 -51.19 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.200000000000003 111.196 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.2 m -151.63 -172.85 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.873 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.445 ' N ' ' HA3' ' A' ' 165' ' ' GLY . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.161 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 72.129999999999995 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.140000000000001 111.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.140000000000001 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.61 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 73.420000000000002 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 71.329999999999998 110.842 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 74.239999999999995 110.85 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.542 HG12 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 72.430000000000007 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.61 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 73.299999999999997 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 65.530000000000001 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.514 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.43 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.469 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.099999999999994 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 75.439999999999998 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.534 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.61 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 64.2 m-70 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 73.099999999999994 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.109999999999999 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.030000000000001 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.61 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.530000000000001 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.408 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.340000000000003 110.897 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.340000000000003 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.400000000000006 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.310000000000002 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.229999999999997 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.510000000000005 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.310000000000002 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.130000000000003 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.310000000000002 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.493 ' NE ' ' O ' ' A' ' 65' ' ' GLY . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.510000000000005 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 74.439999999999998 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.400000000000006 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.595 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.553 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 75.150000000000006 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 61.409999999999997 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.140000000000001 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.548 ' CG ' ' O ' ' A' ' 74' ' ' MET . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 72.329999999999998 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.430000000000007 110.86 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.483 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.219999999999999 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.530000000000001 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.319999999999993 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.421 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.120000000000005 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 55.210000000000001 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 74.530000000000001 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 74.219999999999999 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 74.319999999999993 110.849 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.503 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 73.400000000000006 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 71.319999999999993 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.635 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 75.040000000000006 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.469 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.140000000000001 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.468 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 73.129999999999995 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.579 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.49 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 73.5 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.628 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 74.439999999999998 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.562 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.526 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.450000000000003 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.488 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.010000000000005 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.569 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.479 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -81.7 157.08 24.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.439999999999998 110.859 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.453 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 0.8 OUTLIER -124.28 150.11 45.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 74.129999999999995 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.514 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -164.67 48.18 0.29 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.771 -0.728 . . . . 74.530000000000001 112.503 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.3 Cg_endo -69.87 -163.22 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.716 2.277 . . . . 75.219999999999999 112.335 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.476 ' O ' ' N ' ' A' ' 108' ' ' ALA . 8.4 t80 -124.37 -17.69 6.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 75.019999999999996 110.93 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.471 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 15.4 mmt -37.12 93.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 70.150000000000006 110.884 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -96.72 -150.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 71.349999999999994 111.18 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.548 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.73 -84.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.311 -0.404 . . . . 74.319999999999993 111.081 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.548 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 5.1 mtmt -75.91 96.17 3.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 73.140000000000001 110.895 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.464 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 18.3 mm-40 -141.83 -168.9 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 73.450000000000003 110.875 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.428 ' CG ' ' O ' ' A' ' 112' ' ' LYS . 3.5 ptpp? -150.31 117.06 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.878 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.37 99.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 74.109999999999999 110.864 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -134.97 -67.02 0.56 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.868 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.587 ' CD1' ' N ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.5 -67.19 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.426 . . . . 73.209999999999994 110.951 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 127.86 -40.66 1.7 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.737 -0.744 . . . . 74.319999999999993 112.5 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.502 ' ND2' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -177.94 -170.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.355 . . . . 74.540000000000006 110.868 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.498 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 7.4 mmt180 -94.88 173.36 7.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 72.040000000000006 110.895 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.47 HG13 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.23 -12.66 14.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.450000000000003 111.111 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.485 ' N ' HD11 ' A' ' 120' ' ' ILE . 0.1 OUTLIER -53.89 -32.03 21.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 111.105 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.502 ' CG1' ' ND2' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -68.25 -49.27 68.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 111.176 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.47 ' CG2' HG13 ' A' ' 119' ' ' VAL . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 73.540000000000006 111.144 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.310000000000002 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.447 ' CG ' ' OD1' ' A' ' 102' ' ' ASN . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.439999999999998 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.51 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 72.310000000000002 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.559 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 72.329999999999998 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.559 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.150000000000006 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 71.230000000000004 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.562 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.515 ' O ' ' CG ' ' A' ' 137' ' ' MET . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.239999999999995 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 74.329999999999998 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.450000000000003 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.604 ' HA ' ' CG ' ' A' ' 141' ' ' HIS . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 74.299999999999997 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.129999999999995 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.486 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.049999999999997 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.424 ' CZ ' ' HA3' ' A' ' -5' ' ' GLY . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.430000000000007 110.922 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.483 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.340000000000003 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.604 ' CG ' ' HA ' ' A' ' 136' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.219999999999999 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 74.140000000000001 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 74.540000000000006 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.57 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.471 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.239999999999995 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.530000000000001 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.340000000000003 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 74.349999999999994 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 74.120000000000005 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.443 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.319999999999993 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.430000000000007 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.540000000000006 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.635 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 75.140000000000001 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 71.140000000000001 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.486 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.5 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.450000000000003 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.549 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 71.420000000000002 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 73.140000000000001 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 -54.91 142.15 56.36 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.129999999999995 110.899 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -43.85 2.39 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 73.329999999999998 112.331 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.463 ' N ' HD22 ' A' ' 162' ' ' LEU . 4.0 mm? -94.39 144.02 27.29 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.564 0.697 . . . . 74.219999999999999 110.899 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -50.26 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.697 2.265 . . . . 62.450000000000003 112.335 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.471 ' N ' HD23 ' A' ' 164' ' ' LEU . 0.3 OUTLIER -83.43 -172.58 4.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 61.520000000000003 110.953 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.445 ' HA3' ' N ' ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.239 -1.144 . . . . 65.329999999999998 110.239 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.266 -1.134 . . . . 71.409999999999997 110.266 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.73 -17.53 37.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.643 2.229 . . . . 75.299999999999997 112.404 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.533 ' CD2' ' N ' ' A' ' -3' ' ' LEU . 0.0 OUTLIER -58.36 78.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 75.109999999999999 110.908 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . -114.11 -1.2 23.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.764 -0.731 . . . . 71.010000000000005 112.493 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.74 77.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.879 0.371 . . . . 64.0 110.851 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' N ' ' O ' ' A' ' -2' ' ' GLY . 19.9 ptp -91.06 -54.01 4.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 72.310000000000002 110.915 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.27 176.7 2.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 71.439999999999998 111.046 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -100.81 -77.87 0.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 72.299999999999997 110.871 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -61.31 -21.77 64.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 72.420000000000002 110.897 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -88.11 60.18 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 71.310000000000002 110.919 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -53.03 144.3 28.17 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.656 0.741 . . . . 70.519999999999996 110.876 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 2.82 3.22 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.717 2.278 . . . . 54.210000000000001 112.296 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -25.82 68.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 75.409999999999997 110.921 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 2.2 p-80 -71.31 -47.48 56.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.329999999999998 110.846 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -75.66 -21.82 57.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 72.109999999999999 110.888 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.319999999999993 110.928 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.564 HG21 ' CD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.519999999999996 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.92 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 71.540000000000006 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.475 ' HG ' ' N ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.475 ' N ' ' HG ' ' A' ' 15' ' ' LEU . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 71.549999999999997 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.400000000000006 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.502 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.329999999999998 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.559 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 71.340000000000003 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CG ' ' OD1' ' A' ' 117' ' ' ASN . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.87 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.647 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 74.299999999999997 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 71.25 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -84.27 16.91 2.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 53.340000000000003 111.082 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -111.56 112.65 24.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 74.319999999999993 110.875 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -38.7 158.33 0.1 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.603 0.716 . . . . 74.129999999999995 110.92 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -8.61 24.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.633 2.222 . . . . 74.329999999999998 112.343 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -95.64 6.01 50.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 62.100000000000001 110.846 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -144.55 137.91 14.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.543 0.687 . . . . 71.409999999999997 111.179 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 146.79 61.24 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.641 2.228 . . . . 74.439999999999998 112.323 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' CD ' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -95.28 168.35 11.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 71.230000000000004 110.921 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.78 167.16 25.26 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.674 2.25 . . . . 74.409999999999997 112.38 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 170.16 17.18 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.711 2.274 . . . . 74.150000000000006 112.357 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 174.73 8.99 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.687 2.258 . . . . 72.540000000000006 112.417 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.442 ' CG2' ' CZ ' ' A' ' 14' ' ' ARG . 1.4 m -106.86 -54.23 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.272 -0.422 . . . . 74.109999999999999 111.132 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m -143.31 -173.86 4.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 73.019999999999996 110.773 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 74.120000000000005 111.045 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.219999999999999 110.848 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.239999999999995 111.171 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.412 ' CB ' HD22 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 70.109999999999999 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.606 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.310000000000002 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.617 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.530000000000001 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.617 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 72.510000000000005 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.549999999999997 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.526 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.400000000000006 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.140000000000001 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.557 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.0 m-70 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.230000000000004 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 71.510000000000005 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.319999999999993 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.209999999999994 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.409999999999997 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 73.519999999999996 110.808 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.230000000000004 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.210000000000001 110.861 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.540000000000006 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.430000000000007 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.129999999999995 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.496 ' NE ' ' O ' ' A' ' 61' ' ' CYS . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 75.230000000000004 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.310000000000002 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.299999999999997 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.558 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.554 ' CG2' ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.040000000000006 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 73.439999999999998 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.120000000000005 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.571 ' HE2' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.219999999999999 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.564 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 74.430000000000007 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.450000000000003 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 74.140000000000001 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.566 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 75.450000000000003 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.030000000000001 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 71.420000000000002 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 74.25 110.898 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.614 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.319999999999993 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 64.200000000000003 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 75.25 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 74.120000000000005 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.409999999999997 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.517 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 72.430000000000007 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.569 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 71.420000000000002 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.694 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 63.420000000000002 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.42 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.540000000000006 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.495 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 75.209999999999994 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.502 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.481 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.653 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.462 ' HB3' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.450000000000003 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.329999999999998 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.653 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 73.420000000000002 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.468 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.469 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -88.74 157.44 18.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.219999999999999 110.876 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.451 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 21.8 mm-40 -140.14 150.57 44.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 110.98 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.412 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -178.42 54.56 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.73 -0.748 . . . . 63.219999999999999 112.434 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.472 ' HB3' ' CD ' ' A' ' 118' ' ' ARG . 54.0 Cg_endo -69.8 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.71 2.273 . . . . 75.209999999999994 112.334 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.74 -70.35 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 71.329999999999998 110.988 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.509 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.14 74.32 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 72.430000000000007 110.897 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.2 49.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.209999999999994 111.14 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.512 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 7.3 p -114.43 -50.56 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 72.519999999999996 111.158 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.512 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 19.8 ttpt -92.62 77.99 4.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.445 . . . . 74.25 110.917 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 41.0 mm-40 -134.84 118.32 16.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.842 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.458 ' O ' ' C ' ' A' ' 113' ' ' ARG . 12.7 mttm -75.84 49.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 73.549999999999997 110.902 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.458 ' C ' ' O ' ' A' ' 112' ' ' LYS . 20.9 ptt85 33.99 48.64 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 72.409999999999997 110.83 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.81 -51.82 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 63.539999999999999 110.885 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.496 ' O ' ' N ' ' A' ' 117' ' ' ASN . 0.3 OUTLIER -102.08 -17.05 16.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.888 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' N ' ' CD1' ' A' ' 115' ' ' LEU . . . 35.03 -92.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 44.509999999999998 112.538 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.613 ' ND2' ' CG2' ' A' ' 121' ' ' VAL . 1.8 m120 -58.58 125.45 23.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.743 0.306 . . . . 73.439999999999998 110.962 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.549 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -53.85 -168.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.439999999999998 110.909 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.474 ' O ' ' CG2' ' A' ' 122' ' ' THR . 26.9 m -79.12 -53.95 12.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 74.430000000000007 111.098 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.481 ' CD1' ' HB3' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -50.12 -38.31 14.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 73.420000000000002 111.089 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.613 ' CG2' ' ND2' ' A' ' 117' ' ' ASN . 2.5 p -64.12 -47.04 91.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 61.350000000000001 111.134 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.474 ' CG2' ' O ' ' A' ' 119' ' ' VAL . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 111.113 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.409999999999997 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 65.310000000000002 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.54 ' HG ' ' N ' ' A' ' 126' ' ' CYS . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.230000000000004 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.54 ' N ' ' HG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 75.150000000000006 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.5 ' N ' ' CD1' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 74.239999999999995 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.558 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.530000000000001 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.559 ' CG2' HG13 ' A' ' 20' ' ' ILE . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.439999999999998 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 63.200000000000003 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.462 ' CD2' ' HB3' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.564 ' CD2' HG21 ' A' ' 12' ' ' THR . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 71.150000000000006 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.564 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.140000000000001 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.443 ' CD1' ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.230000000000004 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.563 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 73.230000000000004 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.140000000000001 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.447 ' CB ' ' CZ ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.540000000000006 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.140000000000001 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.430000000000007 111.142 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.040000000000006 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.584 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 74.25 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.478 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 74.349999999999994 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.109999999999999 111.103 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.702 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 71.140000000000001 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.239999999999995 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.549999999999997 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.299999999999997 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 75.319999999999993 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.120000000000005 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.5 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.049999999999997 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.120000000000005 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.464 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.555 ' CD2' HG13 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.349999999999994 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.458 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.532 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.0 t30 -48.29 145.89 5.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.099999999999994 110.913 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 -38.05 8.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.7 2.267 . . . . 75.120000000000005 112.352 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.622 HD23 ' C ' ' A' ' 163' ' ' PRO . 0.0 OUTLIER -58.21 158.02 15.21 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.62 0.724 . . . . 64.040000000000006 110.922 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.622 ' C ' HD23 ' A' ' 162' ' ' LEU . 53.7 Cg_endo -69.86 -88.94 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.635 2.224 . . . . 65.219999999999999 112.354 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.501 ' O ' ' CD2' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -31.18 145.82 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.278 -0.419 . . . . 75.349999999999994 110.884 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.509 0 N-CA-C 110.266 -1.133 . . . . 74.140000000000001 110.266 179.928 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.521 ' N ' ' CD ' ' A' ' -4' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.278 -1.129 . . . . 73.030000000000001 110.278 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' -5' ' ' GLY . 53.1 Cg_endo -69.84 -10.61 28.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.68 2.253 . . . . 73.299999999999997 112.296 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.1 OUTLIER -34.32 -66.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 75.519999999999996 110.895 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 90.89 -174.44 39.13 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.716 -0.754 . . . . 73.329999999999998 112.513 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 p -124.88 162.24 24.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 74.019999999999996 110.851 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tpp -72.62 -53.84 10.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.907 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.96 166.68 19.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 75.420000000000002 111.141 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.53 -37.52 0.84 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 74.230000000000004 110.831 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -63.85 -21.55 66.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 71.209999999999994 110.903 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.414 ' N ' ' OE1' ' A' ' 5' ' ' GLN . 15.4 mp0 -113.57 18.27 17.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.109999999999999 110.869 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.97 164.29 15.85 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.598 0.713 . . . . 73.310000000000002 110.838 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.739 2.292 . . . . 72.310000000000002 112.387 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.446 HD12 ' CD1' ' A' ' 151' ' ' TRP . 8.7 mt -64.78 -5.8 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 75.439999999999998 110.892 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -49.17 -76.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 73.150000000000006 110.871 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -66.71 -25.06 66.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.510000000000005 110.927 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.510000000000005 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.453 ' CG2' HD12 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.530000000000001 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.200000000000003 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.415 ' C ' ' CD ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.129999999999995 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.469 ' CD1' ' C ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.44 HD23 ' CB ' ' A' ' 132' ' ' LEU . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 74.230000000000004 110.819 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 73.109999999999999 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.46 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 72.450000000000003 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.533 ' CG2' ' CE ' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.120000000000005 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.030000000000001 110.92 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.6 17.26 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 111.12 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' O ' ' NH1' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -64.33 111.91 2.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 73.25 110.878 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.39 151.28 60.38 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.579 0.704 . . . . 54.450000000000003 110.892 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -6.6 19.01 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.734 2.289 . . . . 70.239999999999995 112.334 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -99.93 5.72 45.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 110.841 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.412 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.5 t -159.29 126.16 2.57 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.543 0.687 . . . . 74.209999999999994 111.14 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 143.49 50.76 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.694 2.263 . . . . 74.030000000000001 112.321 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' OE2' ' O ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -80.44 148.83 67.38 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.551 0.691 . . . . 63.329999999999998 110.957 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 171.3 14.71 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 74.310000000000002 112.368 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 170.33 16.77 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.731 2.287 . . . . 73.010000000000005 112.3 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.421 ' HD3' ' NH1' ' A' ' 43' ' ' ARG . 54.4 Cg_endo -69.71 158.62 56.39 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.681 2.254 . . . . 75.450000000000003 112.384 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.64 -50.96 4.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.27 -0.423 . . . . 74.420000000000002 111.15 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m -122.7 164.11 18.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.883 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.329999999999998 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 71.319999999999993 111.132 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.469 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.439999999999998 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.646 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 75.140000000000001 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.477 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.130000000000003 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 74.510000000000005 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.572 ' CG2' ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.646 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.519999999999996 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.040000000000006 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.495 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 75.340000000000003 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 75.409999999999997 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.7 m-70 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.319999999999993 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 75.349999999999994 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 72.510000000000005 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.519999999999996 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 53.329999999999998 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.239999999999995 110.875 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.140000000000001 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.010000000000005 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.485 ' O ' ' CD1' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 71.0 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.571 HD13 ' CD1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.329999999999998 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 71.319999999999993 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.575 ' HA ' ' CD2' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 74.010000000000005 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.529 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.319999999999993 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.654 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.49 ' CB ' HD21 ' A' ' 93' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 73.109999999999999 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.521 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.538 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.510000000000005 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.549999999999997 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.409999999999997 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.049999999999997 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.604 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.040000000000006 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.668 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 73.409999999999997 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.32 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.496 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.561 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.329999999999998 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 72.340000000000003 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.487 ' CE ' HD11 ' A' ' 78' ' ' LEU . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.310000000000002 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.49 HD21 ' CB ' ' A' ' 75' ' ' ALA . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 75.530000000000001 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.418 HD11 ' CD1' ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.019999999999996 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.468 ' CB ' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.519999999999996 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.654 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.555 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 73.430000000000007 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 71.030000000000001 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.478 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.599 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.533 ' CE ' ' CG2' ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.129999999999995 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -72.24 152.37 42.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 72.230000000000004 110.863 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.458 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 75.6 mm-40 -150.52 131.68 14.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 61.439999999999998 110.954 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.558 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -154.5 46.02 0.55 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.738 -0.744 . . . . 53.409999999999997 112.527 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.558 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.6 Cg_endo -69.8 -163.47 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.708 2.272 . . . . 71.430000000000007 112.35 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.489 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.6 p90 -124.42 -67.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 75.010000000000005 110.881 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.09 73.37 1.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.487 . . . . 65.030000000000001 110.885 179.947 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.06 58.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 72.420000000000002 111.075 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.497 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 9.4 p -122.73 -51.04 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 55.399999999999999 111.058 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.497 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 2.3 mtmt -98.16 77.32 2.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 71.140000000000001 110.896 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.447 ' O ' ' N ' ' A' ' 113' ' ' ARG . 19.6 mm-40 -133.99 17.44 3.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 74.140000000000001 110.876 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 111' ' ' GLN . 9.7 tppt? 35.16 34.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.219999999999999 110.879 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 111' ' ' GLN . 0.5 OUTLIER 35.56 42.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 74.340000000000003 110.86 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' CG ' ' N ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -92.71 -54.38 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 64.540000000000006 110.899 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.511 ' N ' ' CG ' ' A' ' 114' ' ' ASP . 1.7 pt? -101.88 -16.91 16.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 75.439999999999998 110.89 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.413 ' O ' ' ND2' ' A' ' 117' ' ' ASN . . . 48.82 48.65 29.82 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 70.340000000000003 112.463 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER 40.18 47.33 2.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.808 0.337 . . . . 74.340000000000003 110.875 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.533 ' O ' ' CG2' ' A' ' 122' ' ' THR . 10.0 ptp180 -81.72 34.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.140000000000001 110.828 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.46 ' CG1' ' H ' ' A' ' 120' ' ' ILE . 1.2 p -77.67 -68.84 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 73.420000000000002 111.102 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.46 ' H ' ' CG1' ' A' ' 119' ' ' VAL . 0.2 OUTLIER -86.53 -36.07 9.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 72.019999999999996 111.113 179.948 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.514 ' CG1' ' O ' ' A' ' 117' ' ' ASN . 0.1 OUTLIER -58.99 -41.92 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 71.099999999999994 111.126 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.533 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.521 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.150000000000006 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.492 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 75.299999999999997 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.120000000000005 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.200000000000003 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.0 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.531 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.219999999999999 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.531 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.513 HD21 ' N ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.299999999999997 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.555 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.409999999999997 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.319999999999993 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.473 ' OD1' ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 72.120000000000005 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.552 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.409999999999997 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.453 HD12 ' CG2' ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 75.329999999999998 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.505 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 73.349999999999994 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.150000000000006 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 74.409999999999997 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.497 ' CD ' ' C ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.47 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.540000000000006 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 50.119999999999997 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.414 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.510000000000005 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.58 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.319999999999993 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.475 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.019999999999996 111.135 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.668 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 65.5 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.530000000000001 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 74.129999999999995 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.446 ' CD1' HD12 ' A' ' 8' ' ' LEU . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 72.219999999999999 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.229999999999997 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.530000000000001 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.210000000000001 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.578 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.200000000000003 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.428 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 64.510000000000005 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.51 ' CD1' ' CE1' ' A' ' 154' ' ' PHE . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.420000000000002 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.512 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.5 148.68 3.3 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.010000000000005 110.874 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -38.63 7.49 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.698 2.265 . . . . 72.109999999999999 112.391 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.512 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 3.2 mp -58.81 143.88 82.07 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 75.219999999999999 110.892 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -50.93 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.736 2.29 . . . . 73.540000000000006 112.383 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.5 mp -82.15 156.71 24.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 110.903 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.296 -1.122 . . . . 60.43 110.296 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.308 -1.117 . . . . 74.129999999999995 110.308 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -4.91 14.98 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.682 2.255 . . . . 72.120000000000005 112.293 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.564 ' CD2' ' C ' ' A' ' -3' ' ' LEU . 0.1 OUTLIER -48.84 171.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.340000000000003 110.871 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 139.17 165.31 10.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.695 -0.764 . . . . 70.349999999999994 112.51 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.1 m -159.79 137.94 10.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 71.310000000000002 110.832 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.403 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 19.1 ptm -81.14 -52.91 6.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 74.129999999999995 110.879 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.403 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -135.23 169.88 16.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 111.114 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -138.23 4.7 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 72.140000000000001 110.883 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.5 m -130.54 7.47 4.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 71.530000000000001 110.89 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -100.3 -15.49 18.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 75.530000000000001 110.889 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -113.11 163.74 17.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.711 . . . . 73.129999999999995 110.889 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.4 ' O ' ' CG ' ' A' ' 11' ' ' ARG . 54.1 Cg_endo -69.66 -163.68 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.707 2.271 . . . . 63.409999999999997 112.351 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tp -99.37 -9.48 23.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 72.219999999999999 110.927 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.667 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -69.88 -55.52 9.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 73.329999999999998 110.87 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.667 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.6 pt-20 -74.72 -15.62 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.44 . . . . 75.299999999999997 110.804 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.439 HG23 ' CD2' ' A' ' 133' ' ' TYR . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 74.25 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.109999999999999 110.874 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.536 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.319999999999993 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.701 ' O ' ' CD2' ' A' ' 19' ' ' TYR . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 75.439999999999998 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.455 ' HA ' ' CG1' ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.439999999999998 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.701 ' CD2' ' O ' ' A' ' 16' ' ' LEU . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 72.030000000000001 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.606 HD11 ' CE1' ' A' ' 19' ' ' TYR . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.430000000000007 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.200000000000003 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.129999999999995 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.150000000000006 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.86 15.88 1.64 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 54.509999999999998 111.131 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.11 112.56 24.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 73.319999999999993 110.941 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -44.18 156.5 0.32 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.689 0.756 . . . . 71.040000000000006 110.834 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -10.35 28.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.713 2.275 . . . . 72.310000000000002 112.352 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -91.37 5.74 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 110.923 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 t -139.56 140.78 26.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.556 0.693 . . . . 71.140000000000001 111.125 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.78 136.68 33.57 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.74 2.293 . . . . 73.409999999999997 112.391 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.465 ' CB ' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -84.05 157.94 62.21 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.651 0.739 . . . . 71.230000000000004 110.852 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 169.19 19.5 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.728 2.285 . . . . 65.129999999999995 112.31 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.74 170.15 17.24 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.714 2.276 . . . . 74.129999999999995 112.303 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 171.36 14.67 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.662 2.242 . . . . 64.510000000000005 112.334 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.443 ' CG2' ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -106.03 -48.38 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 73.019999999999996 111.11 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -142.0 -175.32 4.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.822 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.340000000000003 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.140000000000001 111.04 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.209999999999994 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.596 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.010000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.569 ' O ' ' N ' ' A' ' 46' ' ' THR . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 64.230000000000004 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.120000000000005 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.549999999999997 110.803 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.461 ' CG2' ' H ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 62.020000000000003 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.569 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.319999999999993 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 64.450000000000003 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.498 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.540000000000006 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.488 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 4.3 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 74.120000000000005 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.439999999999998 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.519999999999996 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 90.3 m-70 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.340000000000003 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 75.099999999999994 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 74.239999999999995 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.329999999999998 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.109999999999999 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 50.100000000000001 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.412 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 73.230000000000004 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.412 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 71.409999999999997 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 52.0 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.219999999999999 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.471 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.349999999999994 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 71.319999999999993 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.439 HD21 ' N ' ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 72.010000000000005 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.541 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.420000000000002 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 74.340000000000003 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.666 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.019999999999996 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.569 ' CB ' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.566 ' CG ' ' O ' ' A' ' 74' ' ' MET . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 74.239999999999995 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.531 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 75.0 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.58 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.329999999999998 110.911 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.475 ' HA ' ' CE1' ' A' ' 141' ' ' HIS . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.607 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 73.340000000000003 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.446 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.626 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.240000000000002 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.684 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.409999999999997 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.493 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 73.120000000000005 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.567 HD22 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.495 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 74.510000000000005 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.020000000000003 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.574 ' HG ' ' CE2' ' A' ' 19' ' ' TYR . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.513 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.340000000000003 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.666 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 72.140000000000001 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.474 ' CB ' ' OH ' ' A' ' 19' ' ' TYR . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 62.130000000000003 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 100' ' ' LEU . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.109999999999999 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.57 HD13 ' CD2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 73.219999999999999 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.459 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -81.33 134.84 35.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.120000000000005 110.854 -179.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -119.36 116.53 26.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 73.129999999999995 110.894 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.532 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -163.14 47.48 0.32 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.496 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.81 -162.85 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.631 2.22 . . . . 75.030000000000001 112.389 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.537 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.5 t80 -124.04 -13.35 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.010000000000005 110.947 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.494 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 22.5 mmt -36.84 95.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 75.140000000000001 110.876 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.476 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -92.76 -149.57 0.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.310000000000002 111.043 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.586 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.56 -84.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 72.420000000000002 111.098 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.586 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 20.2 ttpt -66.66 87.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.429 . . . . 74.530000000000001 110.949 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 13.4 mm-40 -142.44 150.46 40.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 74.430000000000007 110.874 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 167.96 1.4 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 72.299999999999997 110.88 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 23.5 tpt85 -107.82 -11.81 15.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 74.340000000000003 110.855 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 0.95 54.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.859 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.433 ' N ' HD23 ' A' ' 115' ' ' LEU . 0.5 OUTLIER -76.39 -63.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.895 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 118' ' ' ARG . . . 76.8 27.17 61.18 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 73.420000000000002 112.496 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.8 p-10 40.33 27.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.826 0.346 . . . . 72.099999999999994 110.894 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.527 ' O ' ' CG2' ' A' ' 122' ' ' THR . 5.8 ptt180 -80.8 32.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 62.350000000000001 110.827 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.48 HG21 ' CG2' ' A' ' 120' ' ' ILE . 0.1 OUTLIER -78.95 -66.45 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 74.219999999999999 111.122 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.48 ' CG2' HG21 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -85.56 -40.04 14.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 72.239999999999995 111.054 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG2' ' CE1' ' A' ' 21' ' ' PHE . 0.1 OUTLIER -56.31 -46.52 81.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 75.230000000000004 111.167 179.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.527 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.518 ' N ' ' CG2' ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.109999999999999 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.310000000000002 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.548 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.129999999999995 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.532 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 74.230000000000004 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.548 ' CG2' ' O ' ' A' ' 125' ' ' CYS . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 65.019999999999996 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.917 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 93' ' ' LEU . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.439999999999998 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.517 ' O ' ' CB ' ' A' ' 137' ' ' MET . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.450000000000003 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.109999999999999 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.569 ' CD2' ' CB ' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.566 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 73.319999999999993 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.519999999999996 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.439999999999998 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.469 ' CB ' ' CZ ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 35.7 m-70 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.140000000000001 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 65.409999999999997 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.239999999999995 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.578 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 73.519999999999996 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.49 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 73.420000000000002 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.684 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.219999999999999 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 65.329999999999998 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.120000000000005 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.209999999999994 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.430000000000007 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.109999999999999 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.596 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 75.150000000000006 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 71.409999999999997 110.887 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.57 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 71.109999999999999 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.476 ' CB ' HD12 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.030000000000001 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 71.310000000000002 110.917 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 41' ' ' LEU . 4.5 t30 -48.58 140.17 10.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 62.109999999999999 110.878 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 -37.24 9.49 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.731 2.288 . . . . 63.140000000000001 112.361 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.9 mp -94.02 162.0 28.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.558 0.694 . . . . 65.439999999999998 110.954 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -90.41 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.629 2.22 . . . . 75.030000000000001 112.408 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 165' ' ' GLY . 4.7 mp -115.4 179.28 4.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.329999999999998 110.902 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.51 0 N-CA-C 110.28 -1.128 . . . . 64.409999999999997 110.28 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . 0.443 ' N ' ' OD2' ' A' ' 152' ' ' ASP . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.282 -1.127 . . . . 63.43 110.282 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 1.11 4.73 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.627 2.218 . . . . 74.219999999999999 112.404 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.434 ' CD2' ' C ' ' A' ' -3' ' ' LEU . 0.5 OUTLIER -67.61 85.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.329999999999998 110.857 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 114.73 115.58 3.09 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.66 -0.781 . . . . 62.420000000000002 112.49 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.3 t -122.4 75.55 1.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.888 0.375 . . . . 63.240000000000002 110.824 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -56.18 -33.99 65.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 70.430000000000007 110.899 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.51 176.97 6.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 70.430000000000007 111.094 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -111.93 -18.96 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 65.140000000000001 110.927 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.6 t -127.45 5.27 6.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 75.400000000000006 110.848 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 -99.73 9.74 42.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 73.239999999999995 110.925 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.46 144.24 29.1 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.58 0.705 . . . . 74.109999999999999 110.89 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.728 2.285 . . . . 73.329999999999998 112.392 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.05 -18.99 65.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.45 . . . . 75.219999999999999 110.949 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.641 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 3.3 p80 -66.09 -54.63 23.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.485 . . . . 64.200000000000003 110.837 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.641 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 25.9 tt0 -66.36 -21.05 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.109 -0.496 . . . . 71.140000000000001 110.84 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 74.25 110.951 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.340000000000003 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.489 ' CD1' ' C ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.549999999999997 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' HB3' ' CG2' ' A' ' 129' ' ' VAL . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.120000000000005 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.546 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 73.019999999999996 110.896 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.569 ' CE1' HG22 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 73.430000000000007 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.454 HG22 ' CB ' ' A' ' 125' ' ' CYS . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.299999999999997 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.420000000000002 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.644 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.310000000000002 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.109999999999999 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.75 17.28 4.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 62.340000000000003 111.103 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 87.2 mtt-85 -108.21 112.78 25.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 75.030000000000001 110.876 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 13.3 mt-10 -33.5 147.28 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 121.697 0.76 . . . . 64.129999999999995 110.875 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -16.73 37.63 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.741 2.294 . . . . 70.430000000000007 112.307 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -78.95 5.68 11.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 110.856 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.31 141.02 17.41 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.612 0.72 . . . . 74.329999999999998 111.144 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 136.62 33.4 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.671 2.247 . . . . 74.230000000000004 112.36 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -84.92 158.35 59.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 75.319999999999993 110.872 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.43 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.6 Cg_endo -69.8 170.12 17.36 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.645 2.23 . . . . 72.109999999999999 112.419 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.7 170.41 16.56 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.738 2.292 . . . . 73.409999999999997 112.333 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.702 2.268 . . . . 61.340000000000003 112.383 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.546 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -123.13 -39.93 2.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 70.310000000000002 111.21 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.1 m -137.81 177.38 7.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 73.040000000000006 110.816 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 73.329999999999998 111.06 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.503 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 65.299999999999997 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.430000000000007 111.102 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.597 ' HG ' ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.350000000000001 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 75.409999999999997 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 73.340000000000003 110.819 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.400000000000006 110.844 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.491 ' CG2' ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 73.219999999999999 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.624 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.439999999999998 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 74.319999999999993 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.531 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 73.299999999999997 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.531 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.340000000000003 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.626 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.4 m-70 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.209999999999994 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.200000000000003 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 65.010000000000005 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.626 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 52.509999999999998 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.647 ' CD1' ' CD2' ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 73.040000000000006 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 71.439999999999998 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.445 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.150000000000006 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.329999999999998 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.439999999999998 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.647 ' CD2' ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 74.310000000000002 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.572 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 75.319999999999993 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.592 ' HB3' ' CD2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 72.209999999999994 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.219999999999999 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.509 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.019999999999996 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.559 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.618 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.200000000000003 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.399999999999999 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.465 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.299999999999997 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.743 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 70.140000000000001 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 73.430000000000007 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.645 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.299999999999997 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.659 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.420000000000002 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.400000000000006 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.493 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.576 HD13 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.549999999999997 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.594 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.483 ' CE ' HD12 ' A' ' 78' ' ' LEU . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.519999999999996 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.94 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.568 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 74.299999999999997 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.478 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.616 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.129999999999995 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.535 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.329999999999998 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.523 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 74.230000000000004 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.616 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.48 ' C ' ' O ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -88.98 136.82 32.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.961 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.438 ' NE2' ' HA ' ' A' ' 103' ' ' GLN . 5.9 mm100 -142.68 126.99 17.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.431 . . . . 74.349999999999994 110.918 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.69 46.63 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.696 -0.764 . . . . 72.230000000000004 112.428 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.2 Cg_endo -69.83 -161.68 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.629 2.219 . . . . 63.409999999999997 112.383 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.624 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -93.29 4.02 54.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 72.099999999999994 110.941 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.608 ' SD ' ' N ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.89 91.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 62.310000000000002 110.831 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.85 -154.34 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 72.340000000000003 111.166 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.575 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -67.68 -85.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.428 . . . . 72.329999999999998 111.118 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.575 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 12.7 mtmt -68.83 94.28 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.162 -0.472 . . . . 75.150000000000006 110.914 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -138.86 -172.11 3.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.239999999999995 110.979 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.7 175.23 10.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 65.519999999999996 110.879 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 55.31 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.277 -0.419 . . . . 73.299999999999997 110.904 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -97.03 -55.0 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 75.209999999999994 110.846 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.456 HD13 ' N ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -77.87 -16.11 58.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.310000000000002 110.891 -179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.456 ' N ' HD13 ' A' ' 115' ' ' LEU . . . 45.26 92.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 62.140000000000001 112.528 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.46 ' ND2' HG13 ' A' ' 121' ' ' VAL . 49.5 t30 -34.69 112.35 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.209999999999994 110.851 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.525 ' O ' ' CG2' ' A' ' 122' ' ' THR . 40.4 mtm180 -155.2 16.65 0.41 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 74.430000000000007 110.816 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.6 t -77.05 -69.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 63.100000000000001 111.165 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.423 ' HA ' ' CG ' ' A' ' 123' ' ' ARG . 0.2 OUTLIER -86.35 -32.42 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.143 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.488 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -62.07 -43.33 97.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 74.5 111.152 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' ' CG2' ' A' ' 122' ' ' THR . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 71.349999999999994 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.519999999999996 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.54 ' O ' ' CG1' ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 74.400000000000006 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 65.430000000000007 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 74.409999999999997 110.885 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.566 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.200000000000003 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.566 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.120000000000005 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.592 ' CD2' ' HB3' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 73.140000000000001 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.535 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.209999999999994 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.593 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 64.120000000000005 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 74.030000000000001 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.541 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.532 ' CD1' ' CH2' ' A' ' 151' ' ' TRP . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 75.099999999999994 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.593 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 73.129999999999995 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 70.150000000000006 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.329999999999998 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.465 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.120000000000005 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.9 m-70 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.140000000000001 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.329999999999998 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.617 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.481 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 74.430000000000007 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 74.140000000000001 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 72.200000000000003 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 74.519999999999996 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 73.420000000000002 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 73.340000000000003 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.597 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 74.030000000000001 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.477 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.340000000000003 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.445 ' CB ' HD11 ' A' ' 41' ' ' LEU . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.450000000000003 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 64.409999999999997 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.456 ' CA ' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.96 168.03 0.19 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.530000000000001 110.846 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -44.21 2.22 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.659 2.239 . . . . 74.140000000000001 112.318 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -109.44 110.08 60.03 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.656 0.741 . . . . 73.439999999999998 110.878 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 75.540000000000006 112.364 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.2 mp -101.44 165.51 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.258 -0.428 . . . . 75.0 110.884 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.259 -1.136 . . . . 73.109999999999999 110.259 179.876 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.326 -1.11 . . . . 71.299999999999997 110.326 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.8 -90.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.614 2.209 . . . . 75.349999999999994 112.311 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . 0.441 ' CD1' ' O ' ' A' ' -3' ' ' LEU . 0.7 OUTLIER 48.26 36.4 6.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 110.906 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -143.5 161.1 27.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.767 -0.73 . . . . 72.439999999999998 112.497 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.1 t -108.88 74.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.845 0.355 . . . . 75.310000000000002 110.83 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ptp -91.01 -38.68 12.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 72.340000000000003 110.856 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.95 150.97 36.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.225 -0.443 . . . . 71.519999999999996 111.092 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.09 4.14 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 75.329999999999998 110.848 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.409 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 47.1 t -111.53 51.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.866 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -52.01 -40.54 61.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.430000000000007 110.959 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -110.33 143.14 27.47 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.55 0.691 . . . . 73.299999999999997 110.833 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.67 -9.08 25.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.667 2.245 . . . . 72.109999999999999 112.36 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.47 HD12 ' NE ' ' A' ' 11' ' ' ARG . 0.7 OUTLIER -113.0 11.86 19.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.975 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.656 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 1.9 p80 -69.6 -54.44 14.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 73.439999999999998 110.813 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.656 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 3.1 pt-20 -82.25 -12.35 58.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.438 . . . . 73.349999999999994 110.939 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.47 ' NE ' HD12 ' A' ' 8' ' ' LEU . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.540000000000006 110.873 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.5 ' CG2' ' CD2' ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 74.230000000000004 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 75.310000000000002 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.547 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.469 ' HB3' ' CG1' ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 73.530000000000001 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 65.510000000000005 110.845 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.609 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.530000000000001 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.529 HG13 ' CG2' ' A' ' 129' ' ' VAL . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 74.430000000000007 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 75.150000000000006 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 72.150000000000006 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.08 17.22 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.549999999999997 111.075 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -110.58 112.61 24.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.856 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -38.23 155.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.689 0.757 . . . . 73.129999999999995 110.798 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -12.99 34.17 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.687 2.258 . . . . 74.040000000000006 112.311 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -87.66 5.68 38.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.287 -0.415 . . . . 72.430000000000007 110.877 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.24 141.14 18.69 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.674 0.749 . . . . 73.049999999999997 111.109 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 136.91 34.13 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.632 2.222 . . . . 53.399999999999999 112.325 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.89 156.83 74.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.668 0.747 . . . . 73.420000000000002 110.861 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 169.63 18.49 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.646 2.231 . . . . 74.349999999999994 112.334 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 159.07 54.76 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.703 2.269 . . . . 74.329999999999998 112.339 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 170.16 17.21 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.691 2.26 . . . . 72.019999999999996 112.377 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -97.25 -58.01 2.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 65.5 111.089 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.6 -177.41 4.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 73.420000000000002 110.82 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.499 ' CG1' ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 75.450000000000003 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.467 ' CG ' HD21 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 75.040000000000006 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.140000000000001 111.068 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.435 ' HB2' ' ND2' ' A' ' 160' ' ' ASN . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.602 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 65.409999999999997 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.623 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 72.049999999999997 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 64.230000000000004 110.947 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.540000000000006 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.551 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.623 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.430000000000007 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 73.420000000000002 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 74.040000000000006 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.476 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.109999999999999 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.019999999999996 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.527 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.120000000000005 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.601 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.2 m-70 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.140000000000001 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 75.439999999999998 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.601 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.239999999999995 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 75.030000000000001 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.039999999999999 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 74.450000000000003 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 60' ' ' PHE . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.239999999999995 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 74.219999999999999 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.450000000000003 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.129999999999995 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.476 ' HA ' ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.510000000000005 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.450000000000003 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.040000000000006 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.573 ' HG ' ' CE1' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 64.439999999999998 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.588 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 73.099999999999994 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.588 ' N ' ' CG1' ' A' ' 71' ' ' VAL . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.49 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.120000000000005 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.603 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 75.340000000000003 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.466 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 71.239999999999995 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.530000000000001 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.552 ' CG ' ' O ' ' A' ' 74' ' ' MET . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.514 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 71.129999999999995 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.583 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 74.319999999999993 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 73.319999999999993 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.299999999999997 110.874 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.605 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.519999999999996 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.310000000000002 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.609 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 72.200000000000003 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.409999999999997 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.682 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.479 ' CB ' HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 75.510000000000005 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.575 HD23 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 74.040000000000006 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 75.120000000000005 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.466 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.239999999999995 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.609 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 74.010000000000005 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.487 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.219999999999999 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.603 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.496 ' CB ' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 61.530000000000001 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.130000000000003 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.5 ' N ' ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.340000000000003 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.581 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.140000000000001 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.513 ' HE1' ' CG2' ' A' ' 20' ' ' ILE . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.230000000000004 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.47 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -83.73 161.38 21.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.420000000000002 110.926 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -149.76 117.61 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 65.219999999999999 110.897 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.426 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.69 53.29 0.47 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.76 -0.734 . . . . 73.109999999999999 112.524 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.426 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.1 Cg_endo -69.73 -163.32 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.703 2.269 . . . . 74.109999999999999 112.341 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.73 -83.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.94 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.528 ' HE2' ' CG ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -152.05 -156.56 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.109999999999999 110.93 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -142.35 104.59 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 71.310000000000002 111.073 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.47 ' CG1' ' N ' ' A' ' 110' ' ' LYS . 13.0 p -155.24 -52.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 75.219999999999999 111.119 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.47 ' N ' ' CG1' ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.15 77.6 1.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 75.409999999999997 110.896 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -127.97 -60.43 1.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 74.319999999999993 110.88 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.409 ' NZ ' ' HB3' ' A' ' 112' ' ' LYS . 0.3 OUTLIER 38.11 51.03 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 74.049999999999997 110.927 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 72.9 37.44 0.81 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 75.209999999999994 110.914 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -133.49 -1.13 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 62.509999999999998 110.92 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.464 HD21 ' N ' ' A' ' 115' ' ' LEU . 1.9 pt? -46.91 -48.51 21.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.828 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' N ' ' HG ' ' A' ' 115' ' ' LEU . . . 37.22 30.97 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.792 -0.718 . . . . 71.140000000000001 112.474 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 115' ' ' LEU . 1.4 p-10 -47.5 136.28 10.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 74.239999999999995 110.847 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.512 ' O ' ' CG2' ' A' ' 122' ' ' THR . 32.0 ptt180 -158.32 19.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 74.239999999999995 110.919 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -68.91 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 111.133 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.408 ' CD1' ' H ' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.01 -34.03 7.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.187 -0.461 . . . . 71.319999999999993 111.163 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.471 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.62 -42.32 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 72.200000000000003 111.124 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.400000000000006 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.419 ' N ' ' CG2' ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.468 ' HB3' ' CE ' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.030000000000001 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.506 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 70.400000000000006 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.569 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.569 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.510000000000005 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.57 ' CD1' HD21 ' A' ' 135' ' ' LEU . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.329999999999998 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.496 ' CD1' ' CB ' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.409999999999997 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.573 HD21 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.129999999999995 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' ' 134' ' ' ASN . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.230000000000004 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.5 ' CD2' ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.200000000000003 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.519 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.439999999999998 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.464 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.430000000000007 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 72.519999999999996 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.439999999999998 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.611 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.409999999999997 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.47 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.430000000000007 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.682 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 73.109999999999999 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 73.430000000000007 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.329999999999998 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.310000000000002 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 71.209999999999994 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.499 ' SG ' ' CG1' ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.200000000000003 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.329999999999998 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.420000000000002 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.75 ' CE1' ' CE2' ' A' ' 157' ' ' PHE . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.349999999999994 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.496 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.86 151.23 2.25 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 73.219999999999999 110.899 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.75 -49.34 0.57 Allowed 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.707 2.271 . . . . 72.420000000000002 112.352 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.496 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.5 OUTLIER -58.73 161.87 7.68 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.604 0.716 . . . . 75.420000000000002 110.916 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -90.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.717 2.278 . . . . 61.399999999999999 112.319 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 mp -100.74 -175.13 2.81 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.246 -0.434 . . . . 74.409999999999997 110.891 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.25 -1.14 . . . . 64.040000000000006 110.25 179.879 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.273 -1.131 . . . . 40.100000000000001 110.273 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.72 0.66 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.739 2.293 . . . . 73.519999999999996 112.335 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.7 tp -68.39 -24.24 64.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 74.219999999999999 110.939 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -79.0 -72.4 1.19 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 52.32 112.458 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.9 m -99.37 75.24 1.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 72.200000000000003 110.888 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -44.48 62.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.310000000000002 110.889 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.65 175.6 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 74.129999999999995 111.133 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.1 -26.24 12.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 70.109999999999999 110.854 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 t -74.65 -19.28 60.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 52.340000000000003 110.857 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -84.8 32.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 75.329999999999998 110.937 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.693 ' CB ' ' CD2' ' A' ' 9' ' ' HIS . 29.9 m-20 -97.23 146.5 31.46 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.575 0.703 . . . . 74.0 110.838 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -91.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.7 2.267 . . . . 62.210000000000001 112.279 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.444 HD12 ' NE1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -111.59 22.12 15.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 74.030000000000001 110.945 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.693 ' CD2' ' CB ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -62.33 -43.8 97.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 110.844 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.613 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 13.4 tt0 -67.38 -36.96 82.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.299999999999997 110.812 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 74.099999999999994 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.510000000000005 111.161 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 71.439999999999998 110.909 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.542 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.030000000000001 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.542 ' N ' ' HD3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 74.209999999999994 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 74.340000000000003 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 73.239999999999995 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.400000000000006 110.954 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.613 ' CE1' ' CD1' ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.340000000000003 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.613 ' CD1' ' CE1' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.530000000000001 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' CE2' ' CG ' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 73.319999999999993 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.547 ' CB ' ' NE2' ' A' ' 103' ' ' GLN . . . -81.99 17.19 1.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 73.340000000000003 111.088 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -105.04 112.4 25.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 73.099999999999994 110.884 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -46.66 150.83 1.15 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.329999999999998 110.859 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -20.29 35.43 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.669 2.246 . . . . 71.5 112.399 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -76.04 5.63 6.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.207 -0.451 . . . . 73.310000000000002 110.895 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -142.94 140.89 18.61 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.621 0.724 . . . . 75.430000000000007 111.148 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.75 135.4 30.38 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.644 2.229 . . . . 72.430000000000007 112.325 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.586 ' CG ' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -87.12 148.76 45.82 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.65 0.738 . . . . 75.019999999999996 110.88 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 166.82 26.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.675 2.25 . . . . 72.109999999999999 112.369 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 170.8 15.72 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.65 2.233 . . . . 64.129999999999995 112.325 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 172.67 12.17 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.673 2.248 . . . . 74.129999999999995 112.336 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.421 HG21 ' NH2' ' A' ' 14' ' ' ARG . 1.4 m -111.64 -58.26 2.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 73.209999999999994 111.117 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.9 m -115.15 172.28 7.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 71.310000000000002 110.811 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.040000000000006 111.156 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.499 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 73.140000000000001 111.072 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.606 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 72.25 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 46' ' ' THR . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 64.219999999999999 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.862 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 46' ' ' THR . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.619 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 75.230000000000004 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 74.219999999999999 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.535 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 74.299999999999997 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.493 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.5 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.140000000000001 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.319999999999993 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.565 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 65.299999999999997 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.588 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.3 m-70 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 62.229999999999997 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.140000000000001 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.239999999999995 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 75.340000000000003 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 73.420000000000002 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.450000000000003 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.239999999999995 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 74.319999999999993 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 75.010000000000005 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.409999999999997 110.888 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.416 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 72.209999999999994 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.530000000000001 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.469 ' C ' ' O ' ' A' ' 66' ' ' ASN . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 73.150000000000006 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.471 HD21 ' N ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.040000000000006 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 64.299999999999997 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 72.400000000000006 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.219999999999999 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.641 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 71.420000000000002 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.425 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 74.230000000000004 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.049999999999997 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.522 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.129999999999995 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.536 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.605 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.530000000000001 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.837 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 72.120000000000005 110.938 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.430000000000007 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.019999999999996 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.340000000000003 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.140000000000001 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 72.319999999999993 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.687 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.140000000000001 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 65.019999999999996 110.834 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.430000000000007 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.581 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.140000000000001 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.555 HG11 ' CE1' ' A' ' 154' ' ' PHE . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 74.340000000000003 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.483 ' CE ' HD13 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.474 ' HG ' ' N ' ' A' ' 94' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.571 ' HG ' ' CD2' ' A' ' 19' ' ' TYR . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.489 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 71.430000000000007 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.641 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 75.129999999999995 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.452 ' CB ' HD23 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.039999999999999 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.340000000000003 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.507 HG23 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.030000000000001 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.544 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 73.230000000000004 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.469 ' C ' ' O ' ' A' ' 100' ' ' LEU . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.538 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -71.45 151.06 44.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.230000000000004 110.819 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.547 ' NE2' ' CB ' ' A' ' 24' ' ' ALA . 39.2 mm-40 -146.51 122.37 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 72.549999999999997 110.882 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.627 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.21 40.68 0.93 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.728 -0.748 . . . . 52.109999999999999 112.483 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.9 Cg_endo -69.67 -162.9 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.71 2.273 . . . . 75.129999999999995 112.339 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.589 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -116.59 -10.03 11.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 75.540000000000006 110.923 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.484 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 20.5 mmt -36.0 95.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.063 -0.517 . . . . 73.030000000000001 110.921 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.571 ' C ' ' NE2' ' A' ' 111' ' ' GLN . . . -87.2 -106.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.154 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.74 ' N ' HE21 ' A' ' 111' ' ' GLN . 0.6 OUTLIER -121.01 -55.28 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 73.219999999999999 111.184 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -108.31 78.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 74.030000000000001 110.919 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.74 HE21 ' N ' ' A' ' 109' ' ' VAL . 3.2 mp0 -107.08 178.38 4.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 75.019999999999996 110.967 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -78.97 -171.7 2.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.447 . . . . 73.209999999999994 110.905 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -141.57 40.41 1.72 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.935 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -135.04 1.22 2.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 64.209999999999994 110.847 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -53.1 3.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 70.5 110.949 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 57.18 103.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.779 -0.724 . . . . 72.129999999999995 112.447 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.497 ' ND2' HE22 ' A' ' 103' ' ' GLN . 62.5 t30 -37.86 111.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.868 0.366 . . . . 74.109999999999999 110.869 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.517 ' O ' ' CG2' ' A' ' 122' ' ' THR . 16.9 mtm180 -153.87 14.36 0.47 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 72.340000000000003 110.921 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.4 t -78.04 -68.69 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 74.340000000000003 111.149 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.408 ' H ' ' CD1' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.32 -32.02 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 111.07 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.485 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -63.01 -43.06 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 75.540000000000006 111.09 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.329999999999998 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.434 ' N ' ' CG2' ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.099999999999994 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.49 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.329999999999998 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.526 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 72.319999999999993 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 70.129999999999995 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.57 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.57 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 72.109999999999999 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.569 HD21 ' N ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.519999999999996 110.888 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.473 ' HG ' ' CD1' ' A' ' 93' ' ' LEU . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.530000000000001 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 71.120000000000005 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.567 HD23 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.572 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.53 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.310000000000002 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.310000000000002 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 75.340000000000003 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.43 ' CG ' ' N ' ' A' ' 141' ' ' HIS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 73.019999999999996 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 40.1 m-70 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 72.329999999999998 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.46 ' C ' ' HD3' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 75.340000000000003 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 75.299999999999997 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 75.400000000000006 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.483 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.486 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 70.129999999999995 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.540000000000006 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 74.25 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.444 ' NE1' HD12 ' A' ' 8' ' ' LEU . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.439999999999998 110.923 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.439999999999998 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.420000000000002 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.606 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.299999999999997 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.49 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.430000000000007 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.55 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.439999999999998 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.545 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 72.239999999999995 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.545 ' CE1' ' CD2' ' A' ' 157' ' ' PHE . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.430000000000007 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.329999999999998 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.444 ' CB ' HD21 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.65 165.88 0.24 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 62.32 110.846 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 -50.63 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.681 2.254 . . . . 74.430000000000007 112.322 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -99.15 112.77 63.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 75.25 110.902 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -49.86 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.652 2.235 . . . . 74.010000000000005 112.363 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.93 176.96 3.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.213 -0.448 . . . . 75.450000000000003 110.935 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.322 -1.111 . . . . 75.129999999999995 110.322 179.913 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.517 0 N-CA-C 110.264 -1.134 . . . . 73.230000000000004 110.264 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -90.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.654 2.236 . . . . 74.439999999999998 112.377 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.8 tp 56.65 39.6 29.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.917 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 58.25 -167.01 6.35 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.742 -0.742 . . . . 73.209999999999994 112.476 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.1 m -87.04 165.53 15.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 63.039999999999999 110.855 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 ptp -91.06 -54.04 4.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.319999999999993 110.893 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 177.96 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 64.439999999999998 111.11 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -122.39 -76.67 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.109999999999999 110.807 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -64.11 -24.07 67.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 72.25 110.839 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -100.74 53.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 70.25 110.953 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -52.73 107.64 0.89 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.542 0.687 . . . . 72.439999999999998 110.868 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 4.83 1.98 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.644 2.23 . . . . 72.299999999999997 112.344 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' CD2' ' CD1' ' A' ' 151' ' ' TRP . 0.1 OUTLIER -64.67 -26.04 68.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.912 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -48.07 -81.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 74.439999999999998 110.85 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 -59.67 -13.15 8.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 73.329999999999998 110.84 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.438 HG22 ' CD1' ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.430000000000007 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 73.010000000000005 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.485 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 73.409999999999997 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.429 ' CD2' ' HB3' ' A' ' 132' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 71.420000000000002 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 71.439999999999998 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD2' ' CB ' ' A' ' 35' ' ' THR . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 72.409999999999997 110.887 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.59 ' CE2' ' O ' ' A' ' 94' ' ' LEU . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 65.109999999999999 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.524 HG13 ' CG2' ' A' ' 129' ' ' VAL . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 74.140000000000001 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.219999999999999 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.310000000000002 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 64.530000000000001 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.54 17.02 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 74.349999999999994 111.066 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -119.58 113.14 20.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 73.319999999999993 110.831 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -38.79 154.5 0.15 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.638 0.732 . . . . 70.5 110.91 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -13.1 34.33 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.68 2.254 . . . . 72.030000000000001 112.413 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -86.83 5.8 34.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 75.239999999999995 110.88 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -138.32 141.17 30.74 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.646 0.736 . . . . 65.200000000000003 111.105 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 137.54 35.66 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.584 2.189 . . . . 64.0 112.355 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' CG ' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.11 162.84 22.49 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.714 0.768 . . . . 74.540000000000006 110.852 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.75 23.52 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.661 2.24 . . . . 73.239999999999995 112.327 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 170.22 17.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.595 2.197 . . . . 72.239999999999995 112.337 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 165.71 29.98 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.715 2.277 . . . . 75.010000000000005 112.368 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.461 HG21 ' N ' ' A' ' 36' ' ' SER . 0.6 OUTLIER -94.71 -31.69 13.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 73.120000000000005 111.106 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.461 ' N ' HG21 ' A' ' 35' ' ' THR . 8.4 m -161.02 -176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 73.239999999999995 110.861 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.512 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.129999999999995 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.310000000000002 111.143 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 72.049999999999997 111.084 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.584 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.520000000000003 110.903 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 60.520000000000003 110.84 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 46' ' ' THR . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.609 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.209999999999994 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.528 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 74.030000000000001 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.48 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.439999999999998 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 73.140000000000001 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.120000000000005 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.149999999999999 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.510000000000005 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.409999999999997 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.430000000000007 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 60.310000000000002 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 65.349999999999994 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 63.149999999999999 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.129999999999995 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.209999999999994 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.513 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.430000000000007 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 102' ' ' ASN . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.400000000000006 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.530000000000001 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.510000000000005 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.482 HD11 ' CE1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 73.409999999999997 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 72.109999999999999 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.239999999999995 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.657 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.109999999999999 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.299999999999997 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.528 ' CG ' HD22 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 73.120000000000005 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CD1' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 75.400000000000006 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 74.439999999999998 110.877 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.030000000000001 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.583 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 73.409999999999997 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.020000000000003 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.686 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 74.019999999999996 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 75.030000000000001 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.585 HD21 ' CE2' ' A' ' 85' ' ' PHE . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.140000000000001 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.643 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.426 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.471 ' CD2' ' HB2' ' A' ' 75' ' ' ALA . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 74.109999999999999 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.59 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 64.310000000000002 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.497 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 70.219999999999999 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.657 ' CD1' ' CE ' ' A' ' 74' ' ' MET . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HB1' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 74.109999999999999 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.219999999999999 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.508 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.109999999999999 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.566 ' CD2' ' CE2' ' A' ' 96' ' ' PHE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.485 ' C ' ' O ' ' A' ' 100' ' ' LEU . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 50.140000000000001 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -92.43 159.2 15.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.319999999999993 110.911 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 102' ' ' ASN . 2.4 mm100 -137.84 118.39 13.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.959 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.58 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -150.93 43.95 0.69 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.795 -0.716 . . . . 60.409999999999997 112.489 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.58 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.76 -162.73 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.623 2.215 . . . . 71.230000000000004 112.381 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.515 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -86.94 -16.79 34.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 64.200000000000003 110.86 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.476 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 16.1 mmt -36.75 93.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 73.319999999999993 110.828 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.68 -153.1 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 72.109999999999999 111.109 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.588 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.28 -84.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 75.420000000000002 111.133 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.588 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 8.8 mttt -71.55 95.2 1.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 74.239999999999995 110.818 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -141.16 -163.32 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 74.519999999999996 110.914 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' A' ' 113' ' ' ARG . 3.2 tppp? -169.95 149.1 3.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 64.099999999999994 110.892 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.435 ' N ' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -71.26 84.98 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 72.099999999999994 110.893 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -115.51 -53.25 2.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 62.219999999999999 110.842 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.477 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.3 OUTLIER -102.51 -20.6 14.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.953 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.477 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 56.75 114.01 0.01 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.705 -0.76 . . . . 72.420000000000002 112.472 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 116' ' ' GLY . 8.1 p-10 -32.21 110.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.761 0.315 . . . . 61.409999999999997 110.879 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.537 ' O ' ' CG2' ' A' ' 122' ' ' THR . 2.6 ppt_? -154.38 20.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 74.230000000000004 110.804 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 74.5 t -77.91 -68.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 73.230000000000004 111.119 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.426 ' H ' ' CD1' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.83 -33.76 7.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 111.176 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.467 ' CG1' ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -61.5 -42.46 94.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 74.010000000000005 111.147 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.537 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 71.340000000000003 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.456 ' N ' ' CG2' ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.430000000000007 110.912 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.553 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.209999999999994 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.299999999999997 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 64.519999999999996 110.951 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.594 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.349999999999994 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.594 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.010000000000005 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.472 ' CD2' ' HB1' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 73.049999999999997 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' HD21 ' A' ' 134' ' ' ASN . 1.0 OUTLIER -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.554 ' CD1' ' CB ' ' A' ' 75' ' ' ALA . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 75.299999999999997 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.551 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.458 ' N ' HD11 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.219999999999999 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.310000000000002 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 75.200000000000003 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 74.349999999999994 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.140000000000001 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.421 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 73.400000000000006 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.59 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.129999999999995 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.209999999999994 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 75.349999999999994 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 74.430000000000007 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.477 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.430000000000007 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.44 ' CD1' ' CD2' ' A' ' 8' ' ' LEU . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.420000000000002 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.010000000000005 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 72.430000000000007 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.643 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.405 ' SG ' ' O ' ' A' ' 152' ' ' ASP . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 64.25 110.914 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.56 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 72.109999999999999 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.489 ' CB ' HD11 ' A' ' 41' ' ' LEU . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 75.239999999999995 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.453 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 71.120000000000005 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.474 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 16.5 t-20 -49.16 141.26 11.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.299999999999997 110.885 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 -32.19 19.14 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.657 2.238 . . . . 72.310000000000002 112.361 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.583 ' C ' ' CD2' ' A' ' 162' ' ' LEU . 0.1 OUTLIER -57.66 161.46 6.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.656 0.741 . . . . 73.319999999999993 110.937 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.408 ' O ' ' O ' ' A' ' 164' ' ' LEU . 54.2 Cg_endo -69.76 -42.33 3.5 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 65.239999999999995 112.373 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.408 ' O ' ' O ' ' A' ' 163' ' ' PRO . 3.1 mp -52.31 -171.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.26 -0.427 . . . . 73.109999999999999 110.866 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.552 0 N-CA-C 110.276 -1.13 . . . . 63.200000000000003 110.276 179.905 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 110.289 -1.124 . . . . 72.099999999999994 110.289 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 -31.68 19.76 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.666 2.244 . . . . 51.32 112.306 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.6 tp -106.71 105.77 15.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.400000000000006 110.865 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 55.91 -105.16 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.693 -0.765 . . . . 72.519999999999996 112.499 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.3 t -133.93 75.08 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.843 0.354 . . . . 74.120000000000005 110.847 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.7 ttm -90.96 -53.95 4.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 60.219999999999999 110.888 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.417 ' HB3' ' CG ' ' A' ' 5' ' ' GLN . . . -129.67 150.0 51.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 75.329999999999998 111.082 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -122.64 -5.96 8.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 64.420000000000002 110.849 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.9 m -92.24 -7.69 47.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 75.530000000000001 110.814 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.417 ' CG ' ' HB3' ' A' ' 2' ' ' ALA . 1.1 pt20 -120.51 13.21 11.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 71.310000000000002 110.892 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.62 144.52 30.42 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 75.409999999999997 110.862 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -163.75 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.639 2.226 . . . . 74.129999999999995 112.341 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.563 HD21 ' CD1' ' A' ' 151' ' ' TRP . 0.4 OUTLIER -92.63 -25.98 18.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.25 110.924 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -54.56 -71.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 64.010000000000005 110.913 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -56.61 -13.89 2.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 62.409999999999997 110.891 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.472 HG23 ' CD1' ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 64.230000000000004 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.540000000000006 110.902 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.557 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.230000000000004 110.937 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 70.239999999999995 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.540000000000006 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.629 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 73.549999999999997 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.539 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 74.010000000000005 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CD1' ' HB3' ' A' ' 31' ' ' GLU . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.906 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 41.329999999999998 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.444 ' HB2' ' NE2' ' A' ' 103' ' ' GLN . . . -96.09 -14.3 22.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 75.230000000000004 111.09 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -70.62 111.26 5.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 55.350000000000001 110.911 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -41.29 156.44 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.568 0.699 . . . . 73.040000000000006 110.917 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -22.25 32.33 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.627 2.218 . . . . 71.319999999999993 112.322 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -78.02 4.22 12.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 73.420000000000002 110.881 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.5 t -146.03 126.08 6.98 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.546 0.689 . . . . 65.420000000000002 111.14 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 136.15 32.2 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.624 2.216 . . . . 63.329999999999998 112.359 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HB3' ' CD1' ' A' ' 22' ' ' PHE . 32.4 mt-10 -66.48 140.81 96.77 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.628 0.727 . . . . 64.530000000000001 110.905 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 171.8 13.81 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.715 2.277 . . . . 74.010000000000005 112.301 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 170.29 16.97 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.711 2.274 . . . . 71.340000000000003 112.304 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 174.0 10.14 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.717 2.278 . . . . 73.510000000000005 112.377 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.32 -34.6 4.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 74.349999999999994 111.159 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -128.16 176.3 7.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 72.129999999999995 110.794 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.109999999999999 111.154 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 65.409999999999997 110.915 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.152 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.239999999999995 111.139 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.608 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.420000000000002 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' ' CD2' ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.209999999999994 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.483 ' CG2' ' H ' ' A' ' 46' ' ' THR . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.629 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 70.049999999999997 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.099999999999994 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.474 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.340000000000003 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 75.230000000000004 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.575 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.595 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.0 m-70 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.549999999999997 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.430000000000007 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.130000000000003 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.420000000000002 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.595 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.150000000000006 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.129999999999995 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.140000000000001 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' O ' ' A' ' 57' ' ' PHE . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.120000000000005 110.859 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.400000000000006 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.420000000000002 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.459 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.120000000000005 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.409999999999997 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.409999999999997 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.473 ' C ' ' O ' ' A' ' 66' ' ' ASN . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 75.120000000000005 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.521 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 75.219999999999999 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 64.409999999999997 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.578 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.109999999999999 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 74.409999999999997 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.515 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.420000000000002 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' HD21 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.439999999999998 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.019999999999996 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.420000000000002 110.816 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.473 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.430000000000007 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.621 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 74.329999999999998 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 73.129999999999995 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.578 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.299999999999997 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.430000000000007 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.508 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.239999999999995 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.578 HD21 ' CE2' ' A' ' 85' ' ' PHE . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.676 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.48 ' CE ' HD11 ' A' ' 78' ' ' LEU . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.540000000000006 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.478 ' CG ' ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 63.210000000000001 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.575 ' CD2' ' CD1' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.230000000000004 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.602 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.120000000000005 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.452 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.209999999999994 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.420000000000002 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.509 HG21 ' CD2' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 74.549999999999997 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.602 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.474 ' HE3' ' CB ' ' A' ' 124' ' ' ASP . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.510000000000005 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER -70.43 161.59 30.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.120000000000005 110.903 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.444 ' NE2' ' HB2' ' A' ' 24' ' ' ALA . 51.8 mm-40 -146.02 121.86 10.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 74.120000000000005 110.902 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.443 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -175.16 52.87 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.705 -0.759 . . . . 63.310000000000002 112.493 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.1 Cg_endo -69.75 -162.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 73.400000000000006 112.321 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.606 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.6 t80 -123.86 -6.67 7.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 74.239999999999995 110.918 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.45 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -36.61 94.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.103 -0.499 . . . . 72.230000000000004 110.869 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -99.76 -151.13 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.400000000000006 111.128 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.458 HG13 ' N ' ' A' ' 110' ' ' LYS . 8.4 p -80.62 -52.66 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 71.230000000000004 111.163 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.458 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.7 mptt -85.31 84.06 7.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.914 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -143.72 158.84 43.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.872 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -67.6 -30.36 69.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 74.450000000000003 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 63.1 mtm180 -137.21 178.38 7.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 62.340000000000003 110.873 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.471 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.42 -67.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 62.119999999999997 110.893 179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.446 ' N ' HD13 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.98 -9.7 47.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 63.539999999999999 110.912 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -79.71 62.21 4.17 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.692 -0.766 . . . . 73.230000000000004 112.458 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.522 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 p-10 -99.65 68.99 1.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 71.129999999999995 110.873 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.514 ' O ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -113.94 36.6 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.883 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -79.27 -68.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.267 -0.424 . . . . 75.409999999999997 111.195 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.451 ' H ' ' CD1' ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.29 -36.83 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.420000000000002 111.103 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.522 ' CG1' ' O ' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -58.97 -41.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 74.439999999999998 111.093 179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.514 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 73.129999999999995 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.434 ' N ' ' CG2' ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.409999999999997 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.474 ' CB ' ' HE3' ' A' ' 101' ' ' MET . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.527 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 74.530000000000001 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.219999999999999 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.575 ' CD1' ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 75.420000000000002 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.575 ' N ' ' CD1' ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.219999999999999 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.510000000000005 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.319999999999993 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.478 ' HG ' ' CG ' ' A' ' 93' ' ' LEU . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.519999999999996 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.535 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 75.540000000000006 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.467 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 72.140000000000001 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 74.310000000000002 110.896 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.535 ' CD2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.200000000000003 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.455 ' O ' ' N ' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.25 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.489 ' O ' ' CB ' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 74.340000000000003 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.473 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 73.049999999999997 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CE1' ' CD2' ' A' ' 85' ' ' PHE . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 65.519999999999996 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.583 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.299999999999997 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . 0.489 ' CB ' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 73.420000000000002 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.553 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 61.130000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.481 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.340000000000003 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 64.0 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.099999999999994 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.563 ' CD1' HD21 ' A' ' 8' ' ' LEU . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.510000000000005 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.448 ' C ' ' OD1' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.340000000000003 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 72.230000000000004 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.676 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.430000000000007 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 75.109999999999999 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.567 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.219999999999999 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.340000000000003 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.431 ' CE1' ' CD1' ' A' ' 154' ' ' PHE . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 72.120000000000005 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 72.129999999999995 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.533 ' HB3' ' CD1' ' A' ' 162' ' ' LEU . 1.9 t30 -48.1 146.47 4.31 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 62.439999999999998 110.868 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -38.08 8.33 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.716 2.277 . . . . 75.099999999999994 112.345 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.557 ' O ' ' CD1' ' A' ' 162' ' ' LEU . 0.0 OUTLIER -58.12 153.09 37.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.6 0.714 . . . . 73.519999999999996 110.882 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . 0.434 ' C ' HD23 ' A' ' 162' ' ' LEU . 53.9 Cg_endo -69.76 -89.08 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.64 2.227 . . . . 64.430000000000007 112.348 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.439 ' CD2' ' O ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -110.99 150.87 28.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 110.956 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.287 -1.125 . . . . 70.150000000000006 110.287 179.935 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.275 -1.13 . . . . 74.010000000000005 110.275 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.74 -90.83 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.676 2.25 . . . . 72.340000000000003 112.395 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 5.8 tp 38.78 26.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 73.340000000000003 110.928 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 151.22 33.78 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.739 -0.743 . . . . 62.32 112.451 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.9 m -105.74 106.46 16.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.877 0.37 . . . . 64.219999999999999 110.86 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.507 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 1.7 ptt? -90.98 -48.14 7.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 65.540000000000006 110.878 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.507 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -169.19 145.86 3.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 61.020000000000003 111.018 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -81.91 -52.79 6.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.129999999999995 110.84 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 59.5 p -69.21 -33.71 73.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 71.319999999999993 110.863 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 38.59 25.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 75.109999999999999 110.939 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.7 OUTLIER -71.46 131.78 86.21 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.532 0.682 . . . . 71.019999999999996 110.888 179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -15.74 37.24 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.695 2.264 . . . . 75.409999999999997 112.327 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 tp -98.01 -1.18 43.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 75.530000000000001 110.893 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.69 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 0.5 OUTLIER -71.62 -54.33 10.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 75.400000000000006 110.849 179.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.69 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 9.0 tm-20 -74.93 -15.19 60.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 74.439999999999998 110.882 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.419 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.400000000000006 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.549999999999997 110.909 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.540000000000006 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.51 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.129999999999995 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.129999999999995 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.612 ' CE1' ' CG2' ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.47 HD13 ' CG2' ' A' ' 128' ' ' ILE . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' HA ' ' CG ' ' A' ' 31' ' ' GLU . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.400000000000006 110.907 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.585 ' CB ' ' NE2' ' A' ' 103' ' ' GLN . . . -108.85 -11.96 14.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 75.120000000000005 111.092 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' CB ' ' CD ' ' A' ' 31' ' ' GLU . 2.9 mmt85 -72.24 113.13 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 74.120000000000005 110.82 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' A' ' 25' ' ' ARG . 56.6 mm-40 -28.87 143.01 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.663 0.744 . . . . 63.409999999999997 110.884 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 -17.21 37.25 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 71.239999999999995 112.352 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.45 4.62 8.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.242 -0.435 . . . . 74.019999999999996 110.877 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.451 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.4 t -150.64 124.88 4.52 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.586 0.708 . . . . 75.109999999999999 111.178 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 134.87 29.09 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.259 . . . . 60.310000000000002 112.4 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -74.33 155.74 87.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 62.520000000000003 110.896 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 170.6 16.21 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 2.26 . . . . 73.219999999999999 112.315 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 170.96 15.23 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.73 2.287 . . . . 74.099999999999994 112.313 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 177.08 5.98 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.624 2.216 . . . . 71.040000000000006 112.369 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.54 -28.25 6.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.083 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -137.28 166.92 22.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 50.140000000000001 110.844 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 74.409999999999997 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.450000000000003 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.209999999999994 111.065 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.219999999999999 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.609 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.130000000000003 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.535 ' O ' ' N ' ' A' ' 46' ' ' THR . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.019999999999996 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 62.43 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.530000000000001 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 41' ' ' LEU . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 71.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.612 ' CG2' ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 74.120000000000005 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 70.329999999999998 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.540000000000006 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.473 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.099999999999994 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.219999999999999 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.522 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 74.109999999999999 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.59 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.6 m-70 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 75.319999999999993 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.59 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.549999999999997 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.409 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 43.049999999999997 110.863 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.120000000000005 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.340000000000003 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.319999999999993 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.310000000000002 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.530000000000001 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.518 ' N ' ' CD ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 72.439999999999998 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.049999999999997 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.47 ' N ' HD11 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.519999999999996 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 74.450000000000003 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.299999999999997 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.576 ' HG3' ' CZ ' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.239999999999995 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.43 ' O ' ' O ' ' A' ' 79' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.349999999999994 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.519 ' CD ' ' O ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.319999999999993 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 75.540000000000006 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.659 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.310000000000002 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.430000000000007 110.925 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 75.299999999999997 110.901 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.507 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.539999999999999 110.905 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.582 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 65.349999999999994 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.100000000000001 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.614 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 72.219999999999999 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 72.400000000000006 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.459 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.109999999999999 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.566 HG12 ' CE1' ' A' ' 154' ' ' PHE . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 64.519999999999996 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.474 ' CE ' HD11 ' A' ' 78' ' ' LEU . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.519999999999996 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.497 ' CD1' ' HB3' ' A' ' 132' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.52 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.329999999999998 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.464 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 72.420000000000002 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.636 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.109999999999999 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.514 ' CB ' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 75.530000000000001 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.469 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.129999999999995 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.489 HG21 ' N ' ' A' ' 100' ' ' LEU . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.239999999999995 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.636 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 73.340000000000003 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.466 ' CG ' ' HB1' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.481 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -72.91 152.92 41.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 73.5 110.918 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.585 ' NE2' ' CB ' ' A' ' 24' ' ' ALA . 19.7 mm-40 -144.46 93.04 2.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 75.0 110.975 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -150.21 71.33 0.3 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.713 -0.756 . . . . 72.030000000000001 112.551 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -162.91 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.724 2.283 . . . . 65.329999999999998 112.327 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.473 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -123.28 -67.91 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.95 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.539 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.32 73.54 1.54 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 63.299999999999997 110.851 179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.423 ' HB3' ' NH1' ' A' ' 118' ' ' ARG . . . -77.08 96.9 4.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 53.0 111.109 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.464 HG12 ' N ' ' A' ' 110' ' ' LYS . 11.9 p -151.44 -52.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 71.530000000000001 111.119 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.464 ' N ' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -100.11 77.6 2.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 75.5 110.92 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -133.94 161.28 35.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.230000000000004 110.876 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 113' ' ' ARG . 14.1 tptt -131.51 95.0 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 71.239999999999995 110.903 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 112' ' ' LYS . 33.1 ttp85 -34.78 97.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.5 110.919 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 112' ' ' LYS . 5.1 t70 -123.78 -57.69 1.62 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 73.530000000000001 110.841 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.409 HD13 ' C ' ' A' ' 115' ' ' LEU . 0.2 OUTLIER -99.9 -12.37 19.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.040000000000006 110.911 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 170.52 -138.46 4.99 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.737 . . . . 41.140000000000001 112.504 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.497 ' O ' ' CZ ' ' A' ' 118' ' ' ARG . 3.9 p-10 -110.62 -29.77 7.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.351 . . . . 72.329999999999998 110.903 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.514 ' O ' ' CG2' ' A' ' 122' ' ' THR . 5.0 tpp180 -151.57 171.66 17.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 110.864 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.403 HG21 ' N ' ' A' ' 120' ' ' ILE . 27.5 m -78.09 -45.23 27.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.465 . . . . 61.109999999999999 111.194 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.512 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -69.41 -33.34 56.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 74.540000000000006 111.138 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.512 ' N ' ' CD1' ' A' ' 120' ' ' ILE . 5.8 p -71.94 -47.72 54.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 70.150000000000006 111.146 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.514 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 63.109999999999999 111.086 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.491 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.420000000000002 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.536 ' O ' ' CG1' ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 73.310000000000002 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.451 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.409999999999997 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.407 ' CD1' ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 74.319999999999993 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.109999999999999 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.565 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 75.019999999999996 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 72.430000000000007 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.420000000000002 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.514 ' CD2' ' CB ' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.209999999999994 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.59 ' CE2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.209999999999994 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.611 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 70.010000000000005 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.484 ' CD2' ' O ' ' A' ' 132' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.59 ' HG3' ' CE2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 141' ' ' HIS . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.040000000000006 112.504 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 110.863 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 74.430000000000007 110.942 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.611 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 74.120000000000005 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.239999999999995 111.152 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.120000000000005 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.476 HD11 ' C ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 71.430000000000007 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.329999999999998 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.109999999999999 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 62.310000000000002 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.340000000000003 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.429 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 74.340000000000003 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.609 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 74.530000000000001 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.420000000000002 110.859 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.564 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 74.340000000000003 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 63.009999999999998 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.5 ' CD1' ' CD1' ' A' ' 154' ' ' PHE . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.340000000000003 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.456 ' CA ' HD21 ' A' ' 41' ' ' LEU . 3.8 t30 -48.98 140.15 11.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 73.439999999999998 110.923 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -39.09 7.08 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 73.319999999999993 112.355 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.82 159.2 30.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.616 0.722 . . . . 74.319999999999993 110.921 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 -90.35 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.631 2.221 . . . . 71.340000000000003 112.331 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.64 -178.53 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 74.409999999999997 110.883 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.509 0 N-CA-C 110.247 -1.141 . . . . 72.109999999999999 110.247 179.902 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 74.329999999999998 110.295 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 -4.29 13.66 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.741 2.294 . . . . 73.150000000000006 112.336 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 7.5 tp -44.64 112.95 0.48 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 74.519999999999996 110.961 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 151.46 148.64 4.86 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.742 -0.742 . . . . 55.240000000000002 112.445 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 t -165.59 116.33 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.902 0.382 . . . . 73.329999999999998 110.899 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.492 ' SD ' ' CB ' ' A' ' 2' ' ' ALA . 2.8 ppp? -78.19 -41.7 33.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 65.319999999999993 110.851 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.492 ' CB ' ' SD ' ' A' ' 1' ' ' MET . . . -145.46 167.77 22.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 71.150000000000006 111.032 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.8 -44.98 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 71.120000000000005 110.883 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.04 62.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 73.019999999999996 110.858 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.406 ' CD ' ' HB3' ' A' ' 2' ' ' ALA . 0.0 OUTLIER -99.68 -17.8 17.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 71.109999999999999 110.923 -179.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.404 ' CB ' ' HD3' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -110.98 165.96 11.69 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.613 0.721 . . . . 61.450000000000003 110.895 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.502 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.3 Cg_endo -69.73 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.238 . . . . 60.399999999999999 112.388 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.572 HD23 ' CD1' ' A' ' 151' ' ' TRP . 0.1 OUTLIER -92.09 -21.5 20.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.214 -0.448 . . . . 75.519999999999996 110.938 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.709 ' HD1' ' N ' ' A' ' 10' ' ' GLU . 9.1 t-80 -59.01 -83.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 74.439999999999998 110.837 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.709 ' N ' ' HD1' ' A' ' 9' ' ' HIS . 10.3 tp10 -53.66 -16.66 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.109999999999999 110.885 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.502 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.439999999999998 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.530000000000001 111.099 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.099999999999994 110.899 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.040000000000006 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 74.439999999999998 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.483 ' N ' ' HG ' ' A' ' 15' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 71.310000000000002 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 63.32 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 71.019999999999996 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.567 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.120000000000005 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.503 HG13 ' CG2' ' A' ' 129' ' ' VAL . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 75.140000000000001 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.310000000000002 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.55 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.409999999999997 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 73.040000000000006 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.461 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -72.66 -8.46 55.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 72.040000000000006 111.115 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' CG ' ' O ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -32.47 111.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 63.5 110.891 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.38 152.09 2.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.67 0.748 . . . . 75.019999999999996 110.908 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.71 -8.79 24.51 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.678 2.252 . . . . 61.039999999999999 112.377 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.81 5.8 20.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 70.430000000000007 110.919 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -145.0 139.56 15.29 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.599 0.714 . . . . 73.540000000000006 111.089 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 160.68 48.78 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 73.129999999999995 112.314 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.493 ' CB ' ' CE2' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -78.45 147.73 72.47 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.563 0.697 . . . . 74.430000000000007 110.921 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.85 170.05 17.59 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.657 2.238 . . . . 73.239999999999995 112.322 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.61 170.09 17.2 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.762 2.308 . . . . 72.430000000000007 112.363 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 143.99 52.12 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 71.409999999999997 112.336 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -80.98 -58.24 3.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 74.530000000000001 111.162 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.05 -177.22 4.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.433 . . . . 74.439999999999998 110.921 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.154 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.496 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 61.310000000000002 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 64.140000000000001 111.135 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.517 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 154' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.634 ' O ' ' N ' ' A' ' 46' ' ' THR . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 75.209999999999994 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.010000000000005 110.848 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.556 HG13 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.634 ' N ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 74.540000000000006 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.512 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 73.430000000000007 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.491 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 72.5 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.109999999999999 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.219999999999999 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.219999999999999 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.602 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.2 m-70 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 72.239999999999995 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 73.340000000000003 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.602 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 74.099999999999994 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.401 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.340000000000003 110.882 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 64.230000000000004 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.329999999999998 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 65.420000000000002 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.530000000000001 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 75.239999999999995 110.803 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.120000000000005 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 74.150000000000006 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.472 ' NE ' ' HB3' ' A' ' 102' ' ' ASN . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 72.519999999999996 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 74.109999999999999 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.219999999999999 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.547 ' CG1' ' N ' ' A' ' 72' ' ' LYS . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 74.120000000000005 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 73.430000000000007 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.579 ' HG3' ' CE2' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 75.340000000000003 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.472 ' CB ' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.009999999999998 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.511 ' CG ' ' N ' ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 71.329999999999998 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.535 ' CD1' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 71.030000000000001 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.030000000000001 110.851 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.468 ' CD ' ' NH2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.609 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 71.319999999999993 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.319999999999993 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.59 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.349999999999994 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.699 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.200000000000003 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.209999999999994 110.874 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.511 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.230000000000004 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.59 HD21 ' CE2' ' A' ' 85' ' ' PHE . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 74.420000000000002 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.649 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.549999999999997 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.478 ' CE ' HD12 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 70.219999999999999 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.51 ' CG ' ' HG ' ' A' ' 132' ' ' LEU . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.502 ' CD2' ' HG ' ' A' ' 42' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 73.209999999999994 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 111.142 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 74.329999999999998 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.472 ' CB ' HD22 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.409999999999997 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 70.310000000000002 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.52 HG22 ' CD2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.310000000000002 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.627 ' CD1' ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.481 ' HE3' ' CG2' ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.554 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -87.57 161.2 17.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.916 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.502 ' OE1' ' ND2' ' A' ' 117' ' ' ASN . 48.8 mm-40 -144.32 131.48 20.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 62.219999999999999 110.847 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.629 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.43 41.01 0.9 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 74.299999999999997 112.493 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.82 -162.87 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.671 2.247 . . . . 75.019999999999996 112.327 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.5 ' O ' ' N ' ' A' ' 108' ' ' ALA . 1.2 p90 -120.67 5.68 10.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 110.879 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.58 ' CE ' ' CA ' ' A' ' 107' ' ' MET . 0.3 OUTLIER -33.78 93.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 60.439999999999998 110.925 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -85.41 -149.58 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 73.200000000000003 111.087 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.556 ' CG2' ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.28 -84.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 73.209999999999994 111.108 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.556 ' N ' ' CG2' ' A' ' 109' ' ' VAL . 4.5 mttt -121.28 83.99 2.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 75.329999999999998 110.884 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 108' ' ' ALA . 1.4 mp0 -79.13 160.79 26.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 73.340000000000003 110.926 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -7.13 21.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 75.109999999999999 110.851 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -123.9 147.55 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 72.329999999999998 110.865 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -98.66 -50.98 4.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 110.903 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.467 ' N ' HD11 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -73.0 2.66 6.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 74.109999999999999 110.926 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.445 ' C ' ' O ' ' A' ' 115' ' ' LEU . . . -34.64 107.6 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.76 -0.733 . . . . 74.549999999999997 112.527 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . 0.502 ' ND2' ' OE1' ' A' ' 103' ' ' GLN . 1.4 m120 -158.54 126.07 5.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 74.030000000000001 110.937 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.501 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 22.3 tpt180 -45.87 165.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 75.540000000000006 110.858 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.471 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.88 -11.67 14.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 74.430000000000007 111.152 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.516 ' CD1' ' N ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -55.11 -29.37 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 72.430000000000007 111.06 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER -71.33 -47.43 59.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 74.049999999999997 111.105 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.471 ' CG2' HG12 ' A' ' 119' ' ' VAL . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.349999999999994 111.153 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.524 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . 0.539 ' O ' ' CG2' ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.432 ' CD2' ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.577 ' CG2' ' N ' ' A' ' 129' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.450000000000003 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.577 ' N ' ' CG2' ' A' ' 128' ' ' ILE . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.329999999999998 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 74.019999999999996 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.140000000000001 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . 0.51 ' HG ' ' CG ' ' A' ' 93' ' ' LEU . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 75.010000000000005 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 72.430000000000007 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.523 HD22 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 72.540000000000006 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.556 ' C ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.340000000000003 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.507 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.299999999999997 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.009999999999998 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 74.420000000000002 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.468 ' NH2' ' CD ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.219999999999999 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.473 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 73.150000000000006 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.522 ' CD2' ' CH2' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.482 ' HA ' ' CA ' ' A' ' 150' ' ' GLY . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.010000000000005 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.319999999999993 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.482 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.109999999999999 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' TRP . . . . . 0.572 ' CD1' HD23 ' A' ' 8' ' ' LEU . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.400000000000006 110.951 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.310000000000002 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 61.149999999999999 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.649 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.409999999999997 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.484 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.450000000000003 110.915 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' PHE . . . . . 0.556 ' CD2' HG13 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ASN . . . . . 0.51 ' OD1' ' N ' ' A' ' 41' ' ' LEU . 2.5 t30 -48.78 142.65 8.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 74.239999999999995 110.846 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -45.45 1.61 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.738 2.292 . . . . 74.030000000000001 112.324 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.74 143.36 98.72 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.567 0.699 . . . . 74.519999999999996 110.955 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -33.14 17.44 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.608 2.205 . . . . 75.0 112.434 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.71 145.99 8.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 74.420000000000002 110.941 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.451 0 N-CA-C 110.269 -1.132 . . . . 64.230000000000004 110.269 179.897 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.877 0.37 . . . . 75.23 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 63.34 110.854 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.944 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.33 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.023 HD13 ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.4 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 35.23 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 51.24 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.716 ' CE1' HG21 ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.15 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.537 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 63.41 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.864 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB2' ' CG ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 61.12 111.118 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.979 0.419 . . . . 71.01 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 64.1 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 1.023 ' OE1' HD13 ' A' ' 15' ' ' LEU . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 72.01 111.109 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.901 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.23 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.136 HD13 HD23 ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.43 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.52 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.441 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.22 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.698 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.728 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HD2' ' N ' ' A' ' 48' ' ' GLN . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.21 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.482 ' N ' ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.3 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.4 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 70.33 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.633 ' OE1' ' CE1' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 29.0 m80 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.32 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 71.45 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.23 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.03 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 72.32 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.35 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.4 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.22 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.482 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.14 110.952 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.41 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.14 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.71 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 63.42 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.21 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.607 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 54.34 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.719 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 61.24 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 72.21 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.24 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 70.0 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 51.31 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 73.0 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.44 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.414 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 64.11 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.51 110.888 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.13 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 44.11 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.883 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 71.43 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 71.43 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.683 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.44 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.21 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.12 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.883 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.12 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.849 HG12 ' CD2' ' A' ' 42' ' ' LEU . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.04 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.422 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 62.35 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 93' ' ' LEU . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 74.23 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.136 HD23 HD13 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 74.01 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.728 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.34 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.914 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.32 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.12 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 52.44 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.34 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.914 HD21 ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 65.12 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 72.24 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.422 ' OD1' ' C ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 44.02 110.921 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.494 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.913 0.387 . . . . 74.11 111.161 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.32 111.167 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.542 ' O ' HD22 ' A' ' 127' ' ' LEU . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 61.54 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.2 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.611 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.01 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.35 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.542 HD22 ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.23 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.719 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 74.2 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.9 t30 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.24 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 61.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.35 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.624 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 65.42 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.944 HD11 HG21 ' A' ' 12' ' ' THR . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.2 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.717 ' N ' HD12 ' A' ' 136' ' ' LEU . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 32.12 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 71.13 110.907 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 61.51 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.624 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 4.8 m80 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.05 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.33 111.135 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.792 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 73.25 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.792 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 43.33 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.15 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.683 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.4 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.21 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 70.44 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.45 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.24 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.901 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.45 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.23 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.54 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.693 ' HB2' HD11 ' A' ' 41' ' ' LEU . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 63.11 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 53.42 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 72.42 110.96 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 73.34 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.41 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . 1.038 HG21 HD11 ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 72.34 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.11 110.902 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.32 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.769 HD11 HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.33 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.805 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 52.33 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.41 110.875 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.574 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.693 HG22 ' HG2' ' A' ' 101' ' ' MET . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.01 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 55.43 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.613 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.34 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 61.44 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.453 ' HB2' ' HG3' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.33 111.117 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.957 0.408 . . . . 54.14 110.835 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.448 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.45 111.084 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.725 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.2 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 63.12 111.092 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.01 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.847 HD12 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.04 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.868 HD13 HD23 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 71.35 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 71.32 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.34 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.665 HG13 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 73.43 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.766 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 52.41 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.44 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.43 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 44.33 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.11 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.43 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.12 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.631 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 71.05 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.23 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 44.41 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 72.22 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.631 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 64.11 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 53.14 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 70.41 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.04 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.3 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.04 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.416 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.24 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.41 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 72.11 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.924 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 73.54 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.739 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.11 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.24 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.2 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.924 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.04 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.882 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 54.34 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.22 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 64.04 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.719 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.52 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 52.23 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.899 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.34 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.924 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.21 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.924 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 43.4 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.452 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 63.41 110.894 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.474 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.41 110.923 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.404 ' C ' ' OE1' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.24 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.464 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.45 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 64.34 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 64.42 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.903 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 74.03 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.35 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.15 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.33 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 63.14 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.22 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.441 HD21 ' CA ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 73.23 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.868 HD23 HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.44 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.766 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.41 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.884 ' CE2' HD11 ' A' ' 100' ' ' LEU . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.44 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.004 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.14 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.574 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 71.42 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.14 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.943 HD12 HD11 ' A' ' 128' ' ' ILE . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 64.52 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.693 ' HG2' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.495 ' N ' ' O ' ' A' ' 100' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.35 110.901 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.918 0.389 . . . . 73.34 111.142 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 64.33 111.087 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 72.01 110.977 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.523 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.31 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.685 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.11 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.14 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.943 HD11 HD12 ' A' ' 100' ' ' LEU . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.53 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.795 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 71.14 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.0 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 74.13 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.004 HD11 ' HB2' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.21 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.566 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.41 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 43.54 110.896 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.31 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.929 ' N ' HD13 ' A' ' 136' ' ' LEU . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 64.31 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.32 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.23 110.853 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.474 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.32 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.6 m80 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.51 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.23 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 32.1 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 62.25 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.778 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.03 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.778 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.54 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 63.51 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.14 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.33 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.1 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.23 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 51.34 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.622 ' HB2' ' CZ3' ' A' ' 87' ' ' TRP . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.41 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.847 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.11 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.34 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.708 ' HB2' HD11 ' A' ' 41' ' ' LEU . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.33 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.24 110.954 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 42.51 110.844 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.828 0.347 . . . . 73.31 110.868 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.51 110.91 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . 1.047 HG21 HD21 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.4 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 65.52 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 63.43 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.731 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 63.14 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.4 ' HA ' HG12 ' A' ' 20' ' ' ILE . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.925 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.24 110.837 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 64.31 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.518 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.11 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.3 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.35 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.42 111.038 -179.954 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 70.14 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.607 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 54.43 111.106 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.702 ' HB2' HD22 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 53.2 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 50.11 111.115 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.4 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.13 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 65.31 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 71.34 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.449 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 64.42 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.778 HG11 ' CD2' ' A' ' 158' ' ' PHE . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 61.11 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.768 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.52 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 71.12 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 70.45 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.486 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.14 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.21 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 70.22 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.651 ' OE2' ' CE1' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.651 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 29.3 m80 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.14 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.03 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.53 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.652 ' CB ' HG21 ' A' ' 99' ' ' THR . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.13 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.51 110.794 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.2 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.42 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.14 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 53.43 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 54.31 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.15 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.594 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.4 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.653 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 64.1 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 44.13 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 62.32 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 1.023 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.23 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.633 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 52.34 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 73.2 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.34 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.893 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 44.24 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 70.23 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.955 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 64.32 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 70.24 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 44.12 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 64.52 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB2' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 51.41 110.9 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.44 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 52.3 110.946 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 53.33 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.541 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 62.51 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.11 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.976 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 72.14 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 55.2 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 61.02 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.976 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 52.42 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.03 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.432 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 73.15 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.767 HD23 ' C ' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.22 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.31 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.768 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 72.41 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.933 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.41 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.82 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 61.21 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 40.14 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.4 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.933 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 64.4 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 101' ' ' MET . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 45.23 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 10.2 p30 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.11 110.862 -179.958 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.628 HG13 ' N ' ' A' ' 122' ' ' THR . 7.7 p . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.836 0.35 . . . . 75.24 111.152 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.628 ' N ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.32 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 73.21 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.52 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.847 ' O ' HG23 ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 62.04 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.32 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 1.023 HG12 HG21 ' A' ' 71' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.43 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 125' ' ' CYS . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 63.42 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 44.04 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.633 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.82 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 62.1 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.679 ' O ' HD23 ' A' ' 136' ' ' LEU . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 54.43 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.893 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 60.13 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 12' ' ' THR . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 51.35 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.75 ' N ' HD23 ' A' ' 136' ' ' LEU . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 63.25 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 64.34 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.33 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.461 ' CD ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.845 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.1 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.507 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.14 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.55 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.21 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 63.1 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.617 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.32 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.32 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.01 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.42 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.485 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.31 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CZ2' HD11 ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 64.24 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.01 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.02 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.34 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.607 ' SG ' HG12 ' A' ' 37' ' ' VAL . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 53.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.581 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.04 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.419 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.2 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.32 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.21 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.479 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 70.23 110.912 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.841 0.353 . . . . 64.23 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.448 ' HD2' ' N ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.15 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.977 ' CG2' HD21 ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.33 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 61.0 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.53 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' CD ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 43.52 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.665 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.32 110.958 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 61.15 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.21 110.912 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.788 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.51 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.771 HG23 ' HG3' ' A' ' 101' ' ' MET . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 73.51 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 71.34 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 63.11 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 72.15 111.067 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.856 0.36 . . . . 70.22 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.402 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 65.21 111.177 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.799 ' CD ' HD22 ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.01 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.31 111.108 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 50.22 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.863 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.1 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.056 HD13 HD23 ' A' ' 94' ' ' LEU . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.31 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 70.12 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.438 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.41 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.639 HG13 ' O ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 51.52 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.788 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 64.43 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 74.33 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.13 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.493 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.23 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.03 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.613 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 43.3 m80 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 73.21 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.43 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.22 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.34 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.41 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.907 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.12 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.01 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 44.41 110.832 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 65.23 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 55.23 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.401 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.21 110.878 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.34 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 71.34 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.752 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 61.34 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 70.23 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.24 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 53.34 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.843 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 64.32 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.1 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.53 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.838 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 73.2 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.659 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.44 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.01 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.921 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 60.52 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.921 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.13 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.907 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.14 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.459 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.51 110.847 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 55.43 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.21 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.517 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 60.41 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.33 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.619 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 71.13 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.41 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 62.21 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.619 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.844 HG12 HD23 ' A' ' 42' ' ' LEU . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.04 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.424 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.3 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.82 HD11 HD22 ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 45.01 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.056 HD23 HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 72.33 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 53.52 111.126 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.934 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 73.03 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.117 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 53.23 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.44 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.667 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.11 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.934 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.771 ' HG3' HG23 ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 60.0 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.403 ' OD1' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.33 110.904 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.867 0.365 . . . . 73.11 111.158 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.44 111.149 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.32 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.14 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 61.12 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.31 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 70.54 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.872 HD11 HD12 ' A' ' 100' ' ' LEU . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 62.22 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 125' ' ' CYS . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.04 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.53 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.12 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.117 HD11 ' HB2' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.54 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.405 ' HB3' ' O ' ' A' ' 129' ' ' VAL . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.54 110.926 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 64.43 110.904 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.659 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 53.22 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.977 HD21 ' CG2' ' A' ' 12' ' ' THR . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 60.22 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.54 ' N ' HD12 ' A' ' 136' ' ' LEU . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.23 110.912 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.43 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.432 ' CB ' ' HE ' ' A' ' 140' ' ' ARG . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.44 110.9 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 63.21 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.598 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 71.02 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.475 ' O ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.41 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.42 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 54.33 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.852 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.05 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.54 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 53.04 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 24.12 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' GLY . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.52 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.31 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 61.31 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 71.34 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.728 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.31 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.574 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.408 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 62.02 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HB2' HD11 ' A' ' 41' ' ' LEU . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.01 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 64.33 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 55.14 110.901 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.799 0.333 . . . . 60.44 110.844 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.23 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . 1.103 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.43 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.22 110.925 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 70.33 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.891 ' HB3' HG13 ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.402 ' HA ' HG12 ' A' ' 20' ' ' ILE . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 42.11 110.874 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.757 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 64.25 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' SD ' ' A' ' 101' ' ' MET . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 53.04 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.633 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.24 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.55 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 62.43 111.09 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.916 0.389 . . . . 73.21 110.805 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.41 111.145 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.848 ' O ' HD22 ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.15 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.4 111.058 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.13 111.12 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.741 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 62.33 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 50.12 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.89 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 63.41 110.922 -179.876 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.684 HG11 ' HD2' ' A' ' 158' ' ' PHE . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 71.04 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.757 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.04 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.625 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 65.52 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.55 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.24 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 57.8 m80 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.24 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.7 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.15 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.03 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 64.41 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.34 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 53.43 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.14 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 63.33 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 64.32 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.23 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.453 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 62.13 110.864 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 61.42 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.941 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.34 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.75 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 60.33 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 55.23 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.941 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.31 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.637 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.24 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.35 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.44 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.796 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.779 ' HB1' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 41.41 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.895 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.45 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 43.51 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 62.44 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.42 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.31 110.885 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.566 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.54 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 53.11 110.826 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.555 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 64.5 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.751 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 70.31 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 1.075 ' CZ3' HD12 ' A' ' 90' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.23 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 72.13 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.12 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.075 HD12 ' CZ3' ' A' ' 87' ' ' TRP . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 71.23 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.817 HG12 HD11 ' A' ' 42' ' ' LEU . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 63.34 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.625 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.33 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.491 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.52 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.569 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 71.1 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.015 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.4 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.14 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 74.43 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.925 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.32 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.791 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 54.44 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 54.42 110.971 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.492 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.919 0.39 . . . . 63.12 111.144 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.555 HG23 ' N ' ' A' ' 123' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 55.43 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.555 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.41 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.6 ' HA ' HD21 ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.743 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 60.24 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.965 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 64.34 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.965 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.31 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.891 HG13 ' HB3' ' A' ' 16' ' ' LEU . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 51.33 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 63.44 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.015 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 73.51 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.514 ' CE2' ' HB2' ' A' ' 13' ' ' ARG . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.33 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.779 ' CD1' ' HB1' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 71.24 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.103 HD11 HG21 ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 70.23 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.32 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.31 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 62.02 110.892 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.566 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 62.11 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.723 ' NH1' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 61.21 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.54 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.85 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.03 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.809 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.44 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.665 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.34 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.03 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 34.13 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 64.55 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.1 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 51.1 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.639 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.13 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.741 ' HA ' HD23 ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.53 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.556 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.22 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HD2' HG11 ' A' ' 45' ' ' VAL . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 63.35 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.575 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.14 110.933 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.865 0.364 . . . . 74.14 110.895 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.21 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.646 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.41 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 53.14 110.919 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.13 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.829 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.842 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.459 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.842 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.24 110.864 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.764 ' CE1' HG21 ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 54.34 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.885 HG22 ' SD ' ' A' ' 101' ' ' MET . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 60.32 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.24 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 55.41 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.2 111.044 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.919 0.39 . . . . 45.5 110.875 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.21 111.077 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.614 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.14 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 61.45 111.097 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.41 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.944 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.24 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.003 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.21 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.43 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.24 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.687 HG23 ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 51.34 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.575 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 73.3 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.15 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.53 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.33 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.623 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.33 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.14 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 63.42 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 62.41 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.32 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.22 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 71.44 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 61.45 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.44 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.451 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.33 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 54.44 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.81 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.23 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 71.12 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.14 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.44 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 54.55 110.923 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.96 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 44.32 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.703 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 62.02 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.33 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.853 ' HG3' HD23 ' A' ' 78' ' ' LEU . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 43.31 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.86 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.23 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.86 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 61.4 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.41 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 60.35 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 43.43 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.734 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 70.12 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.14 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.81 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.53 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 1.073 ' CE3' HD12 ' A' ' 90' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.44 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' MET . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.11 110.838 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.506 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 24.6 mm-40 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.13 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.073 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.22 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.785 HG11 ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.33 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.575 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 63.24 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.835 HD11 ' HB2' ' A' ' 75' ' ' ALA . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.42 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.003 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.11 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.789 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.24 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 1.004 ' CE2' HD11 ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.23 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.025 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.15 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.23 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.633 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.41 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.004 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 61.33 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.885 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 62.23 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.489 ' N ' ' O ' ' A' ' 100' ' ' LEU . 4.4 p30 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 74.2 110.847 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.919 0.39 . . . . 73.24 111.143 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.415 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 72.25 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.415 ' N ' HG23 ' A' ' 122' ' ' THR . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.899 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.04 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.687 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 71.55 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.24 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 64.25 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.96 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.41 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.842 HG13 ' HB3' ' A' ' 16' ' ' LEU . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 74.4 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.562 ' O ' ' ND2' ' A' ' 134' ' ' ASN . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 70.44 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.025 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.4 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.599 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 60.15 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.647 HD22 ' HA ' ' A' ' 131' ' ' PHE . 11.1 p30 -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.42 110.824 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.735 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 64.13 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.04 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.53 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.05 112.492 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.42 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 64.31 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.42 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.646 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 61.01 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.43 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.812 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.22 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.793 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 64.42 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.24 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 42.21 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 62.24 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.449 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 54.05 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.508 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.23 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.12 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.02 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.944 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.11 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.722 ' HA ' HD12 ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.15 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.692 ' HB2' HD11 ' A' ' 41' ' ' LEU . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.44 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 71.32 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.51 110.918 179.903 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' O ' ' CD ' ' A' ' 10' ' ' GLU . 15.1 tm-20 . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.91 0.386 . . . . 73.32 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.21 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.91 HG21 HD11 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.03 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.24 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.788 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.52 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.35 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.43 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' CE1' HG21 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.33 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.886 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 71.1 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.33 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.639 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.01 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.35 111.075 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.843 0.354 . . . . 72.14 110.888 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 51.43 111.145 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.739 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 73.53 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.05 111.121 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 61.14 111.157 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.816 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.431 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 70.5 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.762 HG11 ' CD2' ' A' ' 158' ' ' PHE . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 71.24 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.733 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.32 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.33 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.2 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.03 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.511 HD13 ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.24 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.35 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.605 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.01 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.13 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.605 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.1 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 72.53 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 62.05 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 61.2 110.886 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.22 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.55 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 63.05 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.31 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.32 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.784 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 72.45 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.44 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 63.41 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.658 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.35 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.902 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 72.44 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.54 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.35 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.634 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.11 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.875 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 52.22 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 70.02 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.868 ' HG3' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 55.01 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.928 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.41 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.928 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.32 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.34 110.838 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HB2' ' CZ ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 64.4 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.3 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.453 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 55.4 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.891 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.43 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.12 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.721 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.34 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.24 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.43 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.891 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.41 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.75 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.53 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 65.31 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.875 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.43 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD13 ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 73.04 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.733 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.52 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 1.001 ' CE2' HD11 ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.35 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.045 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.45 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.545 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.32 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.641 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 61.55 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.001 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 63.15 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.886 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.04 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.32 110.955 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.867 0.365 . . . . 63.54 111.114 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.475 HG23 ' N ' ' A' ' 123' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.11 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.536 ' O ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.02 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.13 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.792 ' O ' HG23 ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.3 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 123' ' ' ARG . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.902 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.941 HD11 HD12 ' A' ' 100' ' ' LEU . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 61.03 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 125' ' ' CYS . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.03 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 71.52 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.045 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.22 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.568 ' O ' HD12 ' A' ' 136' ' ' LEU . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.13 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 60.01 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.501 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 64.14 110.887 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.91 HD11 HG21 ' A' ' 12' ' ' THR . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 60.42 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.1 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 71.35 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.52 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 64.34 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 25.8 m80 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 70.11 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 54.34 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.492 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.13 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.522 ' NH2' ' HB1' ' A' ' 147' ' ' ALA . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.54 110.791 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.815 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 62.04 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.739 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 52.44 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.522 ' HB1' ' NH2' ' A' ' 144' ' ' ARG . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 55.01 111.142 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.721 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 60.35 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 64.24 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 72.34 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.52 ' CH2' HD22 ' A' ' 136' ' ' LEU . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.34 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.35 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 73.14 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.75 ' CE1' HG11 ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 62.25 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.493 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 55.02 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.58 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 62.5 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 53.31 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.816 ' CB ' HD11 ' A' ' 41' ' ' LEU . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.44 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.23 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.712 ' HB2' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.21 110.842 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.91 0.386 . . . . 70.21 110.948 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.818 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.34 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 73.41 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.493 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.859 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 62.41 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 65.32 110.842 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 25.21 110.825 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 70.42 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.568 HG21 ' CB ' ' A' ' 125' ' ' CYS . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.22 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 71.41 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.638 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.21 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.41 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.59 ' CB ' HG21 ' A' ' 121' ' ' VAL . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.12 111.097 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.933 0.397 . . . . 61.42 110.854 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.452 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 72.31 111.197 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.673 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.11 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.2 111.124 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 53.13 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.836 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 62.22 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.82 HD11 HG12 ' A' ' 91' ' ' VAL . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 65.13 110.875 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.32 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.773 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 72.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.771 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.32 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 43.02 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.566 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.33 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.566 HD13 ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.12 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.02 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 53.13 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.561 ' OE2' ' CE1' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.34 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 44.0 m80 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.55 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.31 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.02 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.45 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.12 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 54.24 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.963 ' CE1' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.11 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 71.5 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.02 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 70.22 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.44 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 14.54 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.33 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.673 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.12 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.655 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.2 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.963 HD23 ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.701 HG23 ' CD1' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.22 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.24 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.681 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 70.02 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 60.42 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.888 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.942 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 63.4 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.21 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.51 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.42 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.34 110.861 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.451 ' N ' ' OE1' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.21 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.801 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.32 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.704 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 72.34 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.801 HD21 ' CD2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 64.2 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.82 HG12 HD11 ' A' ' 42' ' ' LEU . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.03 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.02 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.666 HD11 HD22 ' A' ' 132' ' ' LEU . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.42 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.803 HD12 ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.32 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.771 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 52.13 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.828 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 71.11 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.111 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 54.53 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.24 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.663 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.52 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.839 HD12 HD11 ' A' ' 128' ' ' ILE . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 71.32 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.24 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.31 110.882 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.606 HG13 ' N ' ' A' ' 122' ' ' THR . 6.7 p . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.876 0.37 . . . . 63.24 111.114 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.606 ' N ' HG13 ' A' ' 121' ' ' VAL . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.12 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.14 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.543 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.12 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.938 HD12 ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 61.35 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.938 ' N ' HD12 ' A' ' 127' ' ' LEU . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.22 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.44 110.911 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.111 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.582 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.35 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.34 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.535 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.3 110.93 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.595 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.01 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.595 ' HE2' HD12 ' A' ' 136' ' ' LEU . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.22 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.21 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.4 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.501 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 71.2 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 70.42 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 64.44 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 72.54 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 72.51 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.816 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.13 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.741 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.1 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.34 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.704 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.03 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.45 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.41 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.453 ' HZ2' HD11 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.24 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.53 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 63.4 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.23 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.562 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 73.0 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.836 ' CB ' HD11 ' A' ' 41' ' ' LEU . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.41 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 53.13 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.611 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.1 t30 . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 65.03 110.888 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.833 0.349 . . . . 71.42 110.861 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.31 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . 1.039 HG21 HD21 ' A' ' 136' ' ' LEU . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.04 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 73.22 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 70.11 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.739 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 53.54 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 44.21 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.458 ' HA ' HG21 ' A' ' 129' ' ' VAL . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.23 110.868 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 73.45 110.845 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 46' ' ' THR . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 64.25 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.525 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 62.24 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.51 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.41 111.121 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.858 0.361 . . . . 65.31 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.435 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 64.22 111.122 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.736 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.42 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 72.13 111.073 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.22 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.88 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.32 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.673 HG23 ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.872 ' HB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.44 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.02 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.552 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.552 HD13 ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.33 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 62.52 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.3 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 62.54 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 47.5 m80 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.41 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 64.33 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 71.41 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.42 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.11 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 54.44 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.42 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.42 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 63.14 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.03 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.845 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.21 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.74 ' O ' HD13 ' A' ' 100' ' ' LEU . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.32 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.34 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 54.44 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.983 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 71.32 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.43 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.5 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.709 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.21 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.909 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 53.12 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.23 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.858 ' HG2' HD23 ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 52.44 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.913 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.53 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.913 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 70.51 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.768 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.34 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 53.24 110.83 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.506 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.2 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 60.45 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.15 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.44 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.899 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 73.21 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 54.21 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.899 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 71.34 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.548 HG11 ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 64.54 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.433 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.12 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.13 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.762 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.13 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.984 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 64.42 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.814 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.42 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.514 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.53 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.657 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.41 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.984 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 54.2 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.489 ' CB ' ' HD3' ' A' ' 67' ' ' ARG . 1.6 p30 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.44 110.948 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.899 0.38 . . . . 71.23 111.121 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.593 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.12 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.593 ' N ' HG23 ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.31 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.48 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.4 110.878 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.671 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.44 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.0 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.983 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.14 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 70.24 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 71.52 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.814 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 44.45 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.77 ' O ' HD23 ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 64.24 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.909 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.33 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 12' ' ' THR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.32 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.558 ' N ' HD23 ' A' ' 136' ' ' LEU . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.905 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.32 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.45 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.3 110.826 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 61.25 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.14 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.34 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.841 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.53 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.841 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 71.42 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 74.34 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.5 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.44 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.491 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.2 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.24 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 157' ' ' PHE . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.51 112.494 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.88 ' CE1' HD13 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.21 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.796 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 62.3 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 64.45 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.479 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.41 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.78 ' HB2' HD11 ' A' ' 41' ' ' LEU . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.22 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 63.42 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 72.34 110.9 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.795 0.331 . . . . 71.21 110.844 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.22 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.547 ' CG2' HD11 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 71.43 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.51 110.806 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 64.33 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.888 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.655 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.93 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 72.12 110.815 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.44 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' HG21 ' A' ' 46' ' ' THR . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.51 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.782 HG21 ' CB ' ' A' ' 125' ' ' CYS . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.41 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 64.32 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.35 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.44 111.135 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.93 0.395 . . . . 73.21 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 37' ' ' VAL . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.23 111.161 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 61.12 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.14 111.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.45 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.14 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 71.45 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.842 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 73.52 110.85 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.841 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 64.55 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.784 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 72.05 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 51.51 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.04 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.579 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.1 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.45 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 62.33 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.556 ' CD ' ' CE1' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.44 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.632 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 25.3 m80 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 71.42 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.44 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.03 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.41 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.34 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.34 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.4 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.31 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.13 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.31 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.662 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.11 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.716 ' HB2' HD13 ' A' ' 127' ' ' LEU . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.4 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.595 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.54 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.865 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.44 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 73.54 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 51.23 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.5 ' CB ' HD11 ' A' ' 93' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 50.24 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.14 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HG3' HD23 ' A' ' 78' ' ' LEU . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.937 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.937 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.13 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.43 110.86 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.53 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.55 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 72.24 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.421 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.12 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.965 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 53.03 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 62.43 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 73.01 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 92' ' ' MET . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.849 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 63.41 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.965 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 65.31 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.691 HG11 ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 74.31 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.426 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.14 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.67 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 65.42 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.3 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.784 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 62.31 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.938 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 72.52 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.114 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.33 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.528 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.45 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.01 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.938 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.12 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.458 ' HE1' ' HB2' ' A' ' 124' ' ' ASP . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.22 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.44 110.859 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.984 0.421 . . . . 74.33 111.176 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 71.11 111.144 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.31 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 127' ' ' LEU . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.44 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.782 ' CB ' HG21 ' A' ' 20' ' ' ILE . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.34 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.964 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 64.12 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.964 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 64.41 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 125' ' ' CYS . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.32 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.15 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 64.32 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.114 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 61.55 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.24 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 65.41 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 73.33 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.13 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.05 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.05 110.922 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.502 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.34 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.66 ' NE2' HD11 ' A' ' 90' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.22 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 61.31 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.51 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.838 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 73.51 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.756 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.24 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.53 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.34 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 71.44 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 45.01 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.443 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.32 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.43 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.54 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 72.21 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 61.44 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.495 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.1 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.527 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.45 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.841 ' CD2' HG11 ' A' ' 45' ' ' VAL . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 53.0 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.13 110.899 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.804 0.335 . . . . 72.11 110.888 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.405 HH21 ' CZ ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.32 110.928 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.473 HG22 ' HD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.403 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.11 110.92 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 70.21 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 45.31 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 61.14 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.515 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.12 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.601 ' CE2' HG21 ' A' ' 46' ' ' THR . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.33 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.917 HG22 ' SD ' ' A' ' 101' ' ' MET . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 53.33 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.87 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.647 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 43.03 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.46 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 34.11 111.082 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.962 0.411 . . . . 61.51 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 37' ' ' VAL . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 64.52 111.045 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.929 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.22 110.848 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.24 111.171 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.445 ' CB ' HD21 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 53.31 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.13 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.688 ' CD1' HG12 ' A' ' 91' ' ' VAL . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.3 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.845 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.44 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.669 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 70.4 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.597 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.4 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.597 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 62.14 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 65.13 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.33 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.42 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.617 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 51.1 m80 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 64.31 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 52.51 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.22 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.21 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.617 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.41 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 30.44 110.808 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.43 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.23 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 55.01 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.24 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.418 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.21 110.861 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.54 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.43 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.885 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.13 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.811 ' O ' HD13 ' A' ' 100' ' ' LEU . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 73.2 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.31 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 70.43 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.885 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 72.0 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 1.026 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.04 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 72.12 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.12 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.711 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.22 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 1.102 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 41.51 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.45 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.903 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 65.32 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 62.32 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 64.12 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 72.52 110.898 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 65.22 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.508 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.32 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 63.44 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.797 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 70.22 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 70.23 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.731 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.33 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.41 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 71.21 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.797 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 53.03 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.712 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 62.41 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.535 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.54 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.819 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 71.24 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.577 HD11 HD11 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 1.032 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.01 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.809 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.42 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.45 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.586 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.33 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.032 HD11 ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 54.33 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.917 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.45 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.462 ' HB3' ' NE ' ' A' ' 67' ' ' ARG . 6.6 p30 . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.22 110.876 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.777 HG23 ' SD ' ' A' ' 101' ' ' MET . 2.5 p . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.928 0.394 . . . . 54.4 111.134 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.408 ' N ' HG13 ' A' ' 121' ' ' VAL . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.41 111.113 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.41 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 63.11 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.673 ' O ' HG23 ' A' ' 129' ' ' VAL . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.23 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 54.34 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 73.3 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 1.026 ' CG1' HG21 ' A' ' 71' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.53 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.779 HG13 ' HB3' ' A' ' 16' ' ' LEU . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.44 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 44.15 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 54.15 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.809 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.32 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD1' ' HG3' ' A' ' 137' ' ' MET . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 63.25 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 1.102 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.14 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.521 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.23 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.569 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 42.31 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.14 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.54 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 65.44 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 147' ' ' ALA . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.43 111.142 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 71.51 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.827 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 72.05 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.742 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 73.52 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 143' ' ' ALA . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.11 111.103 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.731 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 43.51 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.24 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.34 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.3 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 64.14 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.712 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.12 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.767 ' HA ' HD23 ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 70.23 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.12 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.464 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.32 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.845 ' CD2' HG11 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.35 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.456 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.34 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.617 ' OD1' HD22 ' A' ' 41' ' ' LEU . 2.0 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.1 110.913 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.858 0.361 . . . . 74.51 110.927 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.51 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.611 HG21 HD11 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.53 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.486 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.13 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.43 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.699 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 72.02 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.522 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 65.13 110.819 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.01 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 63.34 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.631 HG22 ' HE3' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.12 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.23 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.03 110.92 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.35 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 73.32 111.12 179.965 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.947 0.403 . . . . 72.51 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.33 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 55.32 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 70.25 111.132 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.24 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.44 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 72.23 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.488 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.13 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 73.04 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.586 HG23 ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.22 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.772 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.52 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.04 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.3 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 54.4 m80 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.24 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.32 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 64.13 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 70.03 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.52 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 71.42 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 41.1 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.33 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.24 110.875 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.14 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.01 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 64.32 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.541 HD21 ' HE1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.33 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.82 HG22 HD21 ' A' ' 132' ' ' LEU . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 70.43 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HE2' ' CE1' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 70.41 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.532 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.32 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.745 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.877 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.22 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 61.44 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.932 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 62.01 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.932 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.51 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.55 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.22 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.05 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.15 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.837 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.04 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.23 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.694 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 64.33 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.24 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.52 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.14 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 60.44 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 63.45 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.448 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.31 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 1.09 HD11 HD22 ' A' ' 132' ' ' LEU . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 70.41 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.792 HD13 HD13 ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.02 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.772 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.52 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 1.002 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.33 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 1.064 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 43.14 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 12.23 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.002 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.41 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.631 ' HE3' HG22 ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 65.24 110.863 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.491 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.927 0.394 . . . . 71.1 111.126 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.545 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 62.12 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.545 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.15 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 128' ' ' ILE . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 72.52 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.2 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 63.21 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.787 ' CG1' HG21 ' A' ' 71' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.22 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.699 HG13 ' HB3' ' A' ' 16' ' ' LEU . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.15 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.429 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.3 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.609 ' CE1' ' HE2' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 1.09 HD22 HD11 ' A' ' 93' ' ' LEU . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.41 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.32 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 54.42 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.877 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.611 HD11 HG21 ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 71.11 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.513 ' HE3' ' CD1' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 62.43 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.15 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 71.43 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.497 ' C ' ' CD ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.24 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.47 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.54 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 35.45 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.52 ' HD2' HD23 ' A' ' 148' ' ' LEU . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.51 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.32 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.701 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.45 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.469 ' HB3' ' HD3' ' A' ' 144' ' ' ARG . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.02 111.135 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 63.14 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.53 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 73.31 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 71.53 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.23 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.715 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.53 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.21 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.578 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 64.41 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.428 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 63.43 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.42 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.42 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.488 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.01 110.874 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.76 0.314 . . . . 75.3 110.804 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.435 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.21 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.823 HG21 HD11 ' A' ' 136' ' ' LEU . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 63.11 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.11 110.874 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 71.51 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.788 HD11 ' CD1' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.32 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.828 ' HB3' HG13 ' A' ' 129' ' ' VAL . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 74.51 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.474 ' HA ' HG13 ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.44 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.775 ' CE1' HD13 ' A' ' 20' ' ' ILE . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 64.34 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.839 HG22 ' SD ' ' A' ' 101' ' ' MET . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.43 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.2 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.13 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.23 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.632 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 25.44 111.131 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.908 0.385 . . . . 74.33 110.822 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.11 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.34 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 42' ' ' LEU . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.14 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.21 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.981 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.01 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.085 HD23 HG12 ' A' ' 91' ' ' VAL . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 62.22 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.12 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.55 110.803 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.651 HG23 ' N ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 60.13 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.651 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.32 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.514 HD13 ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.41 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 70.11 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.44 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.645 ' OE1' ' CE1' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.52 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.645 ' CE1' ' OE1' ' A' ' 52' ' ' GLU . 38.2 m80 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.34 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 74.32 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 62.2 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.12 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.33 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.11 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 35.41 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 60.15 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 65.3 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 50.03 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.22 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.787 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.35 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.2 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.12 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.451 ' N ' HD23 ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 61.43 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.915 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.41 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.42 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 72.21 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.726 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.02 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.866 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 71.03 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.14 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.85 ' HG3' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.919 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 62.12 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 60.14 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.421 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.911 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.41 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.33 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 72.11 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.03 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.788 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.24 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.34 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.725 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.41 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.1 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.513 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 44.21 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.788 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 1.085 HG12 HD23 ' A' ' 42' ' ' LEU . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.02 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 42' ' ' LEU . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.05 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.958 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 53.15 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.859 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 61.14 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.818 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.11 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.958 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 72.54 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.839 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.14 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.12 110.854 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG2' ' CE1' ' A' ' 21' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.878 0.37 . . . . 75.23 111.167 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.573 ' N ' HG23 ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.31 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.815 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 71.05 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.13 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.915 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 54.44 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.828 HG13 ' HB3' ' A' ' 16' ' ' LEU . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 53.13 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.458 ' CG ' ' O ' ' A' ' 126' ' ' CYS . 3.2 m-20 -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.917 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.13 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.859 HD21 ' HB2' ' A' ' 97' ' ' ALA . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.44 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.635 ' O ' HD13 ' A' ' 136' ' ' LEU . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.45 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.11 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.866 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.972 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.885 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.45 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.52 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.44 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.41 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 18.8 m80 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.24 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.55 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.24 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.843 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 71.43 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.726 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.22 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 71.53 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.725 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.22 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 40.44 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.12 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.21 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.43 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.11 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.61 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 61.12 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.829 ' HA ' HD23 ' A' ' 41' ' ' LEU . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 62.51 110.887 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.57 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.33 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 64.04 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.467 ' CB ' HD11 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.03 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 65.32 110.917 179.914 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.981 ' HA ' HD22 ' A' ' 41' ' ' LEU . 4.5 t30 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 60.21 110.878 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.79 0.328 . . . . 71.14 110.84 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.33 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.53 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.592 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 71.44 110.951 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.23 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.73 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.24 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.863 HD11 HD11 ' A' ' 94' ' ' LEU . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 54.23 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 64.32 110.896 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.803 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.3 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.42 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.644 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 70.22 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.11 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.694 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 51.44 111.103 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.895 0.378 . . . . 43.12 110.816 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 64.34 111.06 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.73 ' CG ' HD22 ' A' ' 15' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 64.44 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.12 111.102 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 55.43 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.35 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 63.33 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 65.13 110.819 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.4 110.844 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.678 HG23 ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 54.31 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.44 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 73.44 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.543 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.54 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.11 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 56.5 m80 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.21 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.6 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.2 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 61.21 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.22 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 54.22 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 50.34 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.42 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 1.072 ' CD1' HD21 ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 70.15 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 61.2 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.23 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.15 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.21 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.693 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.02 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.33 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.44 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 1.072 HD21 ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 54.42 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.985 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 60.42 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.615 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.45 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.3 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 64.13 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.22 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.906 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.02 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.91 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.21 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.91 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.2 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.4 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.3 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.759 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 55.14 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 71.52 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.799 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.02 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 70.02 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 1.087 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.42 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.4 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.43 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.087 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.24 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 72.11 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.56 ' HG2' HG21 ' A' ' 49' ' ' ILE . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.25 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.56 ' CD2' HD11 ' A' ' 78' ' ' LEU . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 63.43 110.94 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 73.2 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.565 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.11 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.996 ' CE2' HD11 ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.13 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 63.05 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.33 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.671 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 51.43 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.996 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.44 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.803 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 70.3 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.961 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.875 0.369 . . . . 71.22 111.152 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.22 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 61.22 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.52 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 1.012 ' O ' HG12 ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.41 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 63.01 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 123' ' ' ARG . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 73.44 110.885 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.985 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.2 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 1.012 HG12 ' O ' ' A' ' 125' ' ' CYS . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.12 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 72.11 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.21 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.606 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 62.13 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 65.41 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.624 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.45 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 55.03 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.606 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 64.41 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 53.42 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.33 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.12 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 8.6 m80 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.14 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 62.2 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.24 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.33 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.22 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.691 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.42 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.02 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 72.21 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 70.32 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 72.14 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 62.42 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 72.55 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.718 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 65.43 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.688 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.34 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.35 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.642 ' CD2' HG11 ' A' ' 45' ' ' VAL . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.45 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 55.31 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.68 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.53 110.846 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 3.1 pt-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.887 0.375 . . . . 73.35 110.939 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.54 110.873 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.954 ' CG2' HD21 ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 72.3 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.31 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 64.53 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 70.24 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.521 ' HA ' HG21 ' A' ' 129' ' ' VAL . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 64.33 110.845 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.45 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.732 ' CE1' HG21 ' A' ' 46' ' ' THR . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.53 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.66 HG21 ' CB ' ' A' ' 125' ' ' CYS . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 64.44 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.22 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.623 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.44 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.429 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 64.24 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.55 111.075 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.903 0.382 . . . . 61.15 110.82 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.632 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 73.03 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.776 ' HB2' HD22 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.3 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.14 111.068 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 63.41 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.835 HD21 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 53.31 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 62.14 110.947 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.54 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.8 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.44 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.732 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.43 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 71.33 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.642 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 71.13 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.642 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.11 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.02 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.12 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 51.2 m80 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.14 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 60.44 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.24 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 62.14 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.04 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.442 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 70.15 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.45 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.826 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.13 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.856 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.51 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.986 HD12 HD13 ' A' ' 127' ' ' LEU . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.45 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.826 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 61.31 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.964 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 64.15 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.52 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.12 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.772 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 62.43 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.53 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.86 ' HG3' HD23 ' A' ' 78' ' ' LEU . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.45 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 65.31 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 73.43 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.02 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.48 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 72.24 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.3 110.874 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.495 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.52 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.819 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 65.35 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.41 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.711 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.31 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.499 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.33 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.819 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 65.35 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.51 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 64.22 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.837 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.24 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.835 HD23 HD21 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 42.14 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.697 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.22 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.944 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 70.31 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 54.3 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.13 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.34 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.944 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.14 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.566 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 73.23 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.42 110.926 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.903 0.382 . . . . 62.23 111.124 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.425 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.4 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.425 ' N ' HG23 ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.01 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.566 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.03 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.66 ' CB ' HG21 ' A' ' 20' ' ' ILE . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 51.33 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 55.42 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.986 HD13 HD12 ' A' ' 68' ' ' LEU . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.964 ' CG1' HG21 ' A' ' 71' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.33 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.33 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.51 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.643 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.33 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.976 ' CD1' ' HB2' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.41 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.592 HD22 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.13 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.818 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 65.23 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.954 HD21 ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.2 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.519 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.44 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.48 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 61.44 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.14 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 64.43 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 34.53 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.828 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.703 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.43 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.711 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.22 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 62.22 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 54.43 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.33 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.31 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 61.33 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.632 ' SG ' HG12 ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.2 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.33 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.42 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.944 ' HB2' HD11 ' A' ' 41' ' ' LEU . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.487 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 62.41 110.899 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.815 0.34 . . . . 74.3 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.785 HG21 HD11 ' A' ' 136' ' ' LEU . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.51 111.161 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 54.51 110.909 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.539 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.03 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.41 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.97 ' HB3' HG13 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 64.54 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 64.33 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.563 ' OD2' ' HB1' ' A' ' 39' ' ' ALA . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.4 110.954 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.691 ' CZ ' HD12 ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.34 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.695 HD13 HG22 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.53 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.52 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.565 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 62.53 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 71.13 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.565 ' HB2' ' CG ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.13 111.088 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.956 0.407 . . . . 71.31 110.811 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.447 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.04 111.156 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.34 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.563 ' HB1' ' OD2' ' A' ' 18' ' ' ASP . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 62.04 111.072 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.23 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 70.24 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.99 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 61.2 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 63.3 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 65.02 110.862 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.746 HG11 ' CD2' ' A' ' 158' ' ' PHE . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.11 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.671 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 74.23 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 72.32 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.646 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 63.14 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.646 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.22 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.1 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.14 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.32 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 61.05 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 47.0 m80 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.14 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.24 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 64.3 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 63.14 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.45 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.24 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.42 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.0 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.414 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.888 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.428 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 51.34 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.53 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.77 ' O ' HD13 ' A' ' 100' ' ' LEU . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 71.54 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.674 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.04 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.95 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 63.51 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 71.3 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.22 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.782 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 63.21 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.784 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 61.31 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.05 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.923 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.13 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.923 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.897 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.53 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.402 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.837 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.471 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 61.02 110.938 179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.43 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.511 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.02 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.23 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.14 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 61.21 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.965 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.14 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 64.54 110.834 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.528 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.43 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.965 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.14 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.704 HG12 HD11 ' A' ' 42' ' ' LEU . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 53.05 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.589 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.31 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.99 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 61.44 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.924 ' CE2' HD11 ' A' ' 100' ' ' LEU . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.04 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.34 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.03 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.924 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 55.12 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.565 ' CG ' ' HB2' ' A' ' 24' ' ' ALA . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.12 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.456 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.23 110.819 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.899 0.38 . . . . 62.42 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.454 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.15 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' HG23 ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.1 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.428 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.682 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 55.44 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.95 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.97 HG13 ' HB3' ' A' ' 16' ' ' LEU . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 62.14 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.52 110.888 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.955 HD21 ' HB2' ' A' ' 97' ' ' ALA . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.53 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.43 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 63.22 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.784 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.24 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.962 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.31 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.959 ' N ' HD13 ' A' ' 136' ' ' LEU . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 65.32 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.31 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 52.42 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.471 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 71.22 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 42.4 m80 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 64.55 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.464 ' HD3' ' C ' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 70.14 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 72.22 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.52 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 63.14 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.72 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 53.3 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.41 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.54 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 71.03 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.44 110.923 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.44 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.42 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.702 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.3 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.528 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.14 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.55 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.43 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.548 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 62.24 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.746 ' CD2' HG11 ' A' ' 45' ' ' VAL . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.33 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.585 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 61.1 110.846 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.783 0.325 . . . . 71.3 110.84 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.966 HG21 HD11 ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.41 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.43 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 71.43 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.749 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 54.11 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 64.51 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 52.25 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.666 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 61.03 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.947 HG23 ' HG3' ' A' ' 101' ' ' MET . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 72.04 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.22 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.31 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 63.22 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 53.13 111.066 -179.984 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.91 0.386 . . . . 51.31 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.738 ' CG ' HD22 ' A' ' 15' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.13 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.31 111.143 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 64.52 111.084 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.752 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.54 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.52 110.903 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.22 110.84 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.785 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.716 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.21 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.14 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.589 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 73.13 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.589 HD13 ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 60.54 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.12 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.15 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.51 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.34 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.33 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 70.03 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.43 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.578 ' HE1' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 41.3 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 55.44 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 61.31 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.13 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.21 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.723 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.43 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.642 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 62.3 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 70.31 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.51 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.723 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 72.42 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.782 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 71.45 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.24 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.744 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.24 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.11 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.24 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.893 ' HG2' HD23 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 65.23 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.893 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.03 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.469 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 70.1 110.877 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.407 ' C ' ' OE1' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.03 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.469 ' HG2' ' CB ' ' A' ' 80' ' ' SER . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 64.04 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.815 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.44 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.02 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 1.034 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.33 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 70.55 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.549 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.034 HD12 ' CE3' ' A' ' 87' ' ' TRP . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.14 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.725 HG11 ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.11 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.453 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.22 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.842 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 63.42 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 51.11 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.716 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 52.11 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.898 ' CE2' HD21 ' A' ' 100' ' ' LEU . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.43 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 54.05 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.431 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.12 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.11 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.995 HD12 HD11 ' A' ' 128' ' ' ILE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.33 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.947 ' HG3' HG23 ' A' ' 20' ' ' ILE . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.911 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.933 0.397 . . . . 61.3 111.147 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.461 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 62.23 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.461 ' N ' HG23 ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.912 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.725 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.21 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.3 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 54.13 110.951 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.995 HD11 HD12 ' A' ' 100' ' ' LEU . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.35 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 125' ' ' CYS . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.33 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.3 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.01 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.791 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 71.12 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.21 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 132' ' ' LEU . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.966 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.34 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.871 ' N ' HD13 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.13 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.31 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.03 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 60.44 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.21 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.14 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.423 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 62.04 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.13 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.721 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 62.22 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 63.52 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 73.14 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 52.34 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.43 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.42 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.01 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 71.34 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.725 ' CE1' HG11 ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 70.05 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 55.53 110.914 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.56 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 64.42 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 62.22 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.785 ' CD2' HG11 ' A' ' 45' ' ' VAL . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 65.44 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.455 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 63.44 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.697 ' HA ' HD22 ' A' ' 41' ' ' LEU . 1.3 t30 . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.23 110.885 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.827 0.346 . . . . 60.45 110.891 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.15 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.811 HG21 HD21 ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 62.32 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.54 110.902 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 63.04 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.753 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.55 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.23 110.937 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 42.14 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.54 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.731 ' CE1' HG21 ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 53.51 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.55 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 72.23 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.1 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 74.12 110.906 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 40.52 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 50.32 111.09 179.975 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.927 0.394 . . . . 51.44 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 37' ' ' VAL . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.11 111.154 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 15' ' ' LEU . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 62.12 110.915 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.152 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HB1' HD21 ' A' ' 160' ' ' ASN . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.24 111.139 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.896 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.42 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.075 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 65.13 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.457 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.33 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.726 HG11 ' CD2' ' A' ' 158' ' ' PHE . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 65.2 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.731 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.4 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 62.41 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.1 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.577 HG21 ' HG2' ' A' ' 92' ' ' MET . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.34 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 51.1 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.23 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.12 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.612 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 53.0 m80 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.55 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.43 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.13 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.41 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.612 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.24 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.15 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.13 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.14 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.12 110.859 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.4 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.42 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.12 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.41 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.896 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.41 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.812 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 31.24 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.557 HD13 HD13 ' A' ' 127' ' ' LEU . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 74.04 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.896 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.987 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 62.13 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 61.51 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.721 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.11 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.588 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 71.2 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.918 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.42 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.918 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.44 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.867 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.02 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.465 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.42 110.816 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.43 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.539 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 50.3 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 65.3 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.816 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.04 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.3 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.993 ' CE3' HD12 ' A' ' 90' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.21 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.43 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.24 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.993 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.819 HG12 HD23 ' A' ' 42' ' ' LEU . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 62.55 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.577 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.34 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.574 HD11 ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 40.42 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.075 HD23 HD13 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.23 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 62.21 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.987 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.12 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.845 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.21 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.511 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.42 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.677 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 65.31 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.987 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.21 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 20' ' ' ILE . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.51 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.01 110.903 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.887 0.375 . . . . 74.44 111.093 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.442 HG23 ' N ' ' A' ' 123' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 71.14 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.41 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.531 ' HA ' HD21 ' A' ' 127' ' ' LEU . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.724 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 64.53 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.22 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.998 HD12 ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 73.33 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.998 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.04 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 16' ' ' LEU . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.51 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.32 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 61.25 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.845 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.48 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.588 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.896 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.811 HD21 HG21 ' A' ' 12' ' ' THR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 65.35 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.2 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.13 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.55 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 60.2 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 71.32 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.718 ' NE2' HD12 ' A' ' 79' ' ' LEU . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 64.42 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.583 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.3 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.55 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 44.43 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 63.33 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.903 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 55.45 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.903 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.34 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 34.02 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.1 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.408 ' C ' ' O ' ' A' ' 150' ' ' GLY . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.51 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.448 ' OD1' ' C ' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.34 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 61.51 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.723 ' CE1' HG11 ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.43 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.896 ' HA ' HD23 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 62.1 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.567 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.34 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.726 ' CD2' HG11 ' A' ' 45' ' ' VAL . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 62.02 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.611 ' CA ' HD22 ' A' ' 41' ' ' LEU . 1.9 t30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 61.13 110.868 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.0 tm-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.874 0.369 . . . . 74.44 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.436 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.12 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.4 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.551 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.909 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.54 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.13 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB3' HG23 ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.13 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.45 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.728 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.31 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.652 HG21 ' HA ' ' A' ' 125' ' ' CYS . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.51 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.4 110.907 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.42 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.651 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 73.24 111.092 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.891 0.377 . . . . 44.32 110.844 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.12 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 62.31 111.065 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.22 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.952 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.13 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.946 HD22 HD12 ' A' ' 94' ' ' LEU . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.02 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 54.21 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.53 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.648 HG23 ' N ' ' A' ' 46' ' ' THR . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 63.02 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.728 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 53.2 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 61.13 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.54 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.53 HD13 ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.1 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.22 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.5 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 73.02 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 50.4 m80 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 70.31 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 54.41 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.608 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.55 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 34.15 110.863 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.42 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.43 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.12 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.34 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.32 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.31 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.937 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.12 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.709 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 65.01 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.05 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 64.12 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.937 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.52 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 1.004 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.52 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 61.02 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.3 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.655 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 72.1 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.507 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.35 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.44 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.32 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.756 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 71.52 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.31 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.925 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.901 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.54 110.905 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.468 ' HG2' ' CB ' ' A' ' 80' ' ' SER . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 61.25 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.456 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.1 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.812 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 63.41 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 63.32 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.12 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.889 ' HA ' HD23 ' A' ' 93' ' ' LEU . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.79 HG12 HD23 ' A' ' 42' ' ' LEU . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 61.32 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.435 ' HG2' HG21 ' A' ' 49' ' ' ILE . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.52 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.946 HD12 HD22 ' A' ' 42' ' ' LEU . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.33 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.535 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 63.23 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 1.023 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.47 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.13 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.21 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.023 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 72.44 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.651 ' HG2' ' HB2' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.416 ' O ' ' SD ' ' A' ' 101' ' ' MET . 6.3 p30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.918 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 122' ' ' THR . 5.8 p . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 70.15 111.146 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.497 ' N ' HG13 ' A' ' 121' ' ' VAL . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 54.12 111.086 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.837 ' O ' HD13 ' A' ' 127' ' ' LEU . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.35 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.904 ' O ' HG12 ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 53.33 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.15 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 1.004 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.11 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.904 HG12 ' O ' ' A' ' 125' ' ' CYS . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 73.01 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 62.11 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.42 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.21 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.598 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.21 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.507 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 63.04 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.861 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.598 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.21 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.04 112.504 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.42 110.863 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.536 ' HG3' ' CD2' ' A' ' 141' ' ' HIS . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.21 110.942 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.536 ' CD2' ' HG3' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.12 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.24 111.152 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.12 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 62.01 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.765 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.33 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.11 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.45 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 44.5 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.34 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' TRP . . . . . 0.429 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.41 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.1 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 44.43 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.615 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 72.54 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.761 ' HA ' HD23 ' A' ' 41' ' ' LEU . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.42 110.859 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.564 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 53.51 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 62.44 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.577 ' CD2' HG11 ' A' ' 45' ' ' VAL . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.54 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.34 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.952 ' HA ' HD22 ' A' ' 41' ' ' LEU . 3.8 t30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 60.21 110.923 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.838 0.351 . . . . 72.11 110.885 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' NH2' ' NH2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.14 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.959 HG21 HD11 ' A' ' 136' ' ' LEU . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.53 111.099 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.1 110.899 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.04 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 55.13 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 94' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 64.51 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.23 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 52.05 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.55 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.12 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.934 HG23 ' HG3' ' A' ' 101' ' ' MET . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 55.33 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.31 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.41 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 71.45 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 65.14 111.115 -179.996 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.882 0.372 . . . . 74.44 110.921 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.418 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.23 111.154 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.731 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 55.14 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 40.33 111.135 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.14 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.67 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 72.23 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.866 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 65.1 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.01 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.01 110.848 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.751 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 72.33 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 62.11 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.34 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.7 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 55.15 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.7 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 65.32 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.11 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.22 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 56.4 m80 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.24 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.23 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 70.15 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.12 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 72.43 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.882 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 55.34 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.2 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 45.23 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.53 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.32 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.443 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 64.44 110.803 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.12 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 73.33 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.756 ' O ' HD13 ' A' ' 100' ' ' LEU . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 64.2 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 51.34 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.22 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.568 HD21 ' CE1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.953 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 41.42 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.672 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.22 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.82 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.01 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.91 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 60.4 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.91 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 55.31 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.802 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.03 110.851 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.482 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 61.23 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.21 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 70.22 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.828 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.35 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 1.052 ' CE3' HD12 ' A' ' 90' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.2 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 92' ' ' MET . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.21 110.874 -179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.23 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.052 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 53.22 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.721 HG11 ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.02 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.548 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 53.01 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 75' ' ' ALA . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 62.12 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 16' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 55.23 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.725 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.3 111.142 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.979 ' CE2' HD11 ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 71.41 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.41 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 63.53 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.616 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.31 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.979 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 54.31 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.934 ' HG3' HG23 ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.488 ' HB3' ' NE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.916 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.889 0.376 . . . . 74.05 111.105 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.25 111.153 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ARG . . . . . 0.725 ' O ' HD23 ' A' ' 127' ' ' LEU . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.22 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' CYS . . . . . 0.766 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.43 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.01 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.953 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.45 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 125' ' ' CYS . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.33 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 73.23 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.14 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 55.11 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 70.32 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.03 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.82 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.43 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.003 HD13 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.34 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' MET . . . . . 1.003 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 71.21 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.01 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 52.14 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.482 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.33 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.22 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.473 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 62.44 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.854 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 65.1 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.854 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 65.33 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.01 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 71.34 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.32 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' GLY . . . . . 0.493 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.11 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.23 110.951 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.31 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 33.34 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.721 ' CE1' HG11 ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.41 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.42 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 156' ' ' ARG . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.45 110.915 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 157' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.54 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' PHE . . . . . 0.751 ' CD2' HG11 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 71.42 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.44 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ASN . . . . . 0.53 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.5 t30 . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 71.53 110.846 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.273 -1.131 . . . . 65.14 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -20.41 35.0 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.65 2.233 . . . . 71.13 112.374 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -114.07 -177.37 3.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 70.23 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.13 119.94 2.97 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.689 -0.767 . . . . 62.43 112.533 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.8 t -167.63 156.8 9.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 70.41 110.861 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -18.03 30.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 72.3 110.834 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.95 148.85 24.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 63.4 111.139 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.11 -66.75 0.9 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.322 -0.399 . . . . 50.24 110.859 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -104.08 -20.96 13.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.52 110.923 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -89.42 44.12 1.19 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.156 -0.475 . . . . 72.1 110.86 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HB2' ' CB ' ' A' ' 9' ' ' HIS . 4.0 p30 -57.6 143.82 74.37 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.633 0.73 . . . . 75.31 110.864 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -91.0 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.696 2.264 . . . . 54.32 112.357 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 9' ' ' HIS . 7.6 mp -100.05 -5.15 28.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 73.24 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.426 ' CB ' ' HB2' ' A' ' 6' ' ' ASP . 62.0 t60 -36.61 -71.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 73.35 110.868 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 -74.04 -8.31 55.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 75.23 110.926 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' LEU . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 63.34 110.854 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.944 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.33 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.023 HD13 ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.4 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 35.23 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 51.24 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.716 ' CE1' HG21 ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.15 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.537 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 63.41 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CE1' ' HG2' ' A' ' 32' ' ' PRO . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.864 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 72.32 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -70.85 -8.95 56.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 61.12 111.118 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' CD ' ' HB3' ' A' ' 31' ' ' GLU . 34.2 ptt-85 -34.0 115.55 0.24 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 63.24 110.899 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.587 ' HB2' HG22 ' A' ' 29' ' ' THR . 3.3 mt-10 -38.91 143.6 0.46 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.699 0.761 . . . . 74.11 110.814 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -4.69 14.55 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.223 . . . . 74.42 112.317 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.66 6.76 14.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.231 -0.44 . . . . 74.52 110.856 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.2 t -150.89 127.9 5.43 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 53.42 111.101 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 150.37 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.717 2.278 . . . . 70.44 112.339 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HB3' ' CD ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.33 153.63 71.52 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.633 0.73 . . . . 72.22 110.888 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 53.9 Cg_endo -69.82 170.17 17.26 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 63.11 112.326 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 170.72 15.91 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.62 2.213 . . . . 71.43 112.363 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 169.5 18.68 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.626 2.218 . . . . 73.4 112.402 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.431 HG21 ' NH2' ' A' ' 14' ' ' ARG . 1.4 m -106.72 -36.93 6.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.234 -0.439 . . . . 73.41 111.053 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.63 175.99 9.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 71.01 110.834 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 64.1 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 1.023 ' OE1' HD13 ' A' ' 15' ' ' LEU . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.32 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' HB1' HD23 ' A' ' 162' ' ' LEU . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 72.01 111.109 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.901 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.23 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.136 HD13 HD23 ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.43 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.52 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.441 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.22 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.698 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.728 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HD2' ' N ' ' A' ' 48' ' ' GLN . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.21 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.482 ' N ' ' HD2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.52 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.3 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.4 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 70.33 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.633 ' OE1' ' CE1' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 29.0 m80 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.32 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 71.45 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.23 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.03 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 72.32 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.35 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.4 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.22 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 61.12 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.482 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.14 110.952 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.41 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.14 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.71 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 63.42 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.21 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.607 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 54.34 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.719 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 61.24 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 72.21 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.24 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 70.0 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 51.31 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 73.0 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.44 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.414 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.4 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 64.11 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.51 110.888 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.13 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 44.11 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.883 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 71.43 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 71.43 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.683 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.44 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.21 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.12 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.883 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.12 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.849 HG12 ' CD2' ' A' ' 42' ' ' LEU . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.04 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.422 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 62.35 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 93' ' ' LEU . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 74.23 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.136 HD23 HD13 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 74.01 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.728 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.34 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.914 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.32 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.12 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 52.44 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.34 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.914 HD21 ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 65.12 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 72.24 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.443 ' C ' ' OE1' ' A' ' 103' ' ' GLN . 0.3 OUTLIER -96.51 161.58 13.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 44.02 110.921 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.443 ' OE1' ' C ' ' A' ' 102' ' ' ASN . 6.8 mp0 -128.56 161.53 29.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 62.54 110.853 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.547 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -161.22 46.71 0.38 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 41.32 112.546 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.3 Cg_endo -69.69 -162.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.709 2.273 . . . . 72.11 112.363 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.505 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.19 -70.89 0.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 74.34 110.905 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.636 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.91 72.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 73.04 110.93 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' A' ' 109' ' ' VAL . . . -62.3 -23.45 66.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 71.12 111.048 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.498 HG13 ' N ' ' A' ' 110' ' ' LYS . 4.0 p -31.29 -45.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 73.22 111.13 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.498 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.5 mttm -90.56 82.59 5.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 74.35 110.882 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 108' ' ' ALA . 0.0 OUTLIER -88.74 95.06 10.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 71.55 110.868 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.84 -48.23 59.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 51.13 110.884 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.15 -162.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.857 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -94.38 -4.11 49.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 65.22 110.853 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.58 3.37 47.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 70.42 110.861 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -63.46 99.31 0.28 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.734 -0.746 . . . . 75.55 112.507 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -178.39 146.49 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 63.32 110.928 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.674 ' HB3' HG23 ' A' ' 120' ' ' ILE . 5.9 mmm180 -65.71 167.77 8.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 64.42 110.889 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.493 ' O ' HG22 ' A' ' 122' ' ' THR . 35.2 m -75.6 -12.47 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 73.05 111.129 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.904 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -53.41 -29.87 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 64.34 111.139 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.904 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -70.64 -47.73 62.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.467 . . . . 74.11 111.161 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 119' ' ' VAL . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.32 111.167 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.542 ' O ' HD22 ' A' ' 127' ' ' LEU . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 61.54 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.2 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.611 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.01 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.35 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.542 HD22 ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.23 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.719 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 74.2 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.9 t30 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.24 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 61.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.35 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.624 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 65.42 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.944 HD11 HG21 ' A' ' 12' ' ' THR . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.2 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.717 ' N ' HD12 ' A' ' 136' ' ' LEU . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 32.12 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 71.13 110.907 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 61.51 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.624 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 4.8 m80 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.01 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.05 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.33 111.135 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.792 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 73.25 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.792 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 43.33 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.15 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.683 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.4 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.21 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 70.44 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.45 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.24 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.901 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.45 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.23 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.54 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.693 ' HB2' HD11 ' A' ' 41' ' ' LEU . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 63.11 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 53.42 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.481 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 6.9 t-20 -70.08 143.36 91.33 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 72.42 110.96 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.465 ' HG2' HD22 ' A' ' 162' ' ' LEU . 54.0 Cg_endo -69.74 -47.17 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.726 2.284 . . . . 75.11 112.311 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.501 HD23 ' HB1' ' A' ' 40' ' ' ALA . 3.7 mm? -66.24 150.67 96.73 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.572 0.701 . . . . 73.12 110.906 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.457 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.4 Cg_endo -69.83 -37.81 8.51 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.698 2.265 . . . . 74.14 112.337 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.457 HD22 ' HG2' ' A' ' 163' ' ' PRO . 1.9 mm? -51.49 -174.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.89 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.315 -1.114 . . . . 63.33 110.315 179.912 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.426 ' O ' ' CD ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.295 -1.122 . . . . 71.0 110.295 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.703 ' C ' HD12 ' A' ' -3' ' ' LEU . 53.7 Cg_endo -69.71 -8.39 23.48 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.708 2.272 . . . . 72.41 112.315 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.703 HD21 ' ND2' ' A' ' 134' ' ' ASN . 7.3 mp -127.95 -175.45 3.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 74.03 110.932 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 111.14 152.37 12.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 55.23 112.507 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -120.17 140.96 50.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.829 0.347 . . . . 51.51 110.904 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt -57.56 -42.63 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.0 110.853 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.573 ' HB3' ' OD1' ' A' ' 6' ' ' ASP . . . -125.45 177.7 6.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 72.54 111.088 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -87.22 -55.64 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 74.34 110.93 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.6 t -127.94 -7.52 5.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 72.44 110.914 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.448 ' HB2' ' CB ' ' A' ' 2' ' ' ALA . 9.7 mm-40 -72.97 -7.82 52.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 74.12 110.927 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.573 ' OD1' ' HB3' ' A' ' 2' ' ' ALA . 0.2 OUTLIER -107.57 86.99 3.11 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.654 0.74 . . . . 71.05 110.796 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.72 -0.23 6.58 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.753 2.302 . . . . 63.14 112.37 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -89.02 -26.06 21.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 73.14 110.971 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.546 ' CE1' ' HG3' ' A' ' 10' ' ' GLU . 2.1 p-80 -77.04 -41.47 42.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 63.51 110.863 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HG3' ' CE1' ' A' ' 9' ' ' HIS . 1.4 mt-10 -77.54 -22.1 51.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 73.34 110.906 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.41 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.038 HG21 HD11 ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 72.34 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.11 110.902 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.32 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.769 HD11 HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.33 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.805 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 52.33 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.32 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.41 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.41 110.875 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.574 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.693 HG22 ' HG2' ' A' ' 101' ' ' MET . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.01 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 55.43 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.613 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.34 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 61.44 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.828 ' HB1' ' OE1' ' A' ' 103' ' ' GLN . . . -81.98 17.14 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.33 111.117 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.477 HH12 HD22 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -110.38 112.7 24.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 45.23 110.859 -179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -35.54 153.67 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.586 0.708 . . . . 71.1 110.902 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.88 -10.19 27.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.695 2.263 . . . . 61.54 112.304 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -89.58 5.78 44.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 72.23 110.861 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 t -140.24 140.5 23.55 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-O 121.536 0.684 . . . . 74.41 111.153 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 136.73 33.72 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.647 2.231 . . . . 54.21 112.323 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -76.25 155.14 84.27 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.585 0.707 . . . . 73.04 110.893 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 169.9 17.87 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.682 2.254 . . . . 74.24 112.316 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 170.41 16.72 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.727 2.285 . . . . 74.34 112.268 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.69 -172.09 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.747 2.298 . . . . 73.22 112.319 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.41 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -130.16 -44.15 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 73.12 111.215 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.489 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.4 OUTLIER -134.32 -178.38 5.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 54.14 110.835 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.448 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.45 111.084 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.725 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.2 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.489 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 63.12 111.092 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.01 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.847 HD12 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.04 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.868 HD13 HD23 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 71.35 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 71.32 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.34 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.665 HG13 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 73.43 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.766 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 52.41 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.44 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.43 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 44.33 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.11 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.43 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.12 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.631 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 71.05 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.23 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 44.41 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 72.22 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.631 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 64.11 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 53.14 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 70.41 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.04 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.3 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.04 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.416 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.24 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.41 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 72.11 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.924 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 73.54 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.739 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.11 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.24 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.2 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.924 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.04 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.882 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 54.34 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.22 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 64.04 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.719 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.52 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 52.23 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.13 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.899 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.34 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.924 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.21 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.924 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 43.4 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.452 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 63.41 110.894 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.474 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.41 110.923 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.404 ' C ' ' OE1' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.24 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.464 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.45 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 64.34 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 64.42 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.903 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 74.03 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.35 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.15 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.33 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 63.14 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.22 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.441 HD21 ' CA ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 73.23 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.868 HD23 HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.44 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.766 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.41 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.884 ' CE2' HD11 ' A' ' 100' ' ' LEU . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.44 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.004 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.14 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.574 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 71.42 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.14 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.943 HD12 HD11 ' A' ' 128' ' ' ILE . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 64.52 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.693 ' HG2' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.495 ' N ' ' O ' ' A' ' 100' ' ' LEU . 0.4 OUTLIER -62.86 142.0 58.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.35 110.901 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.828 ' OE1' ' HB1' ' A' ' 24' ' ' ALA . 6.9 mm100 -144.53 126.34 15.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 51.35 110.954 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.609 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.47 42.52 0.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 74.21 112.476 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.0 Cg_endo -69.79 -163.23 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.712 2.275 . . . . 74.54 112.375 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.9 t80 -124.31 -10.04 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 73.52 110.89 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.487 ' HE1' ' OD1' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -36.9 96.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.889 179.93 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -97.21 -152.09 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 64.01 111.059 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.847 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -66.33 -85.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.234 -0.439 . . . . 71.3 111.176 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.847 ' N ' HG22 ' A' ' 109' ' ' VAL . 14.3 mttt -69.88 95.49 0.92 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 72.14 110.866 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.414 ' HG2' ' C ' ' A' ' 110' ' ' LYS . 3.8 mm100 -142.93 166.32 24.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 73.22 110.913 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -154.72 159.63 40.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.192 -0.458 . . . . 71.03 110.951 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.453 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.2 OUTLIER 34.28 35.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.286 -0.416 . . . . 63.01 110.823 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.487 ' OD1' ' HE1' ' A' ' 107' ' ' MET . 6.6 m-20 -99.39 1.27 44.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 62.13 110.909 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.477 HD22 HH12 ' A' ' 25' ' ' ARG . 4.6 mt -45.87 -20.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 64.22 110.918 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . -76.72 59.55 3.39 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.814 -0.707 . . . . 54.44 112.462 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.919 ' ND2' HG11 ' A' ' 121' ' ' VAL . 12.7 p-10 -35.64 153.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.802 0.334 . . . . 73.42 110.903 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 120' ' ' ILE . 6.7 mmt85 -40.86 162.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 64.12 110.823 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.732 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.4 -12.6 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 71.33 111.09 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.866 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -54.19 -30.18 20.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.12 111.155 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.919 HG11 ' ND2' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -70.55 -48.9 56.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 73.34 111.142 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.732 ' CG2' HG12 ' A' ' 119' ' ' VAL . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 64.33 111.087 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 72.01 110.977 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.523 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.31 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.685 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.11 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.14 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.943 HD11 HD12 ' A' ' 100' ' ' LEU . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.53 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.795 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 71.14 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.0 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 74.13 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.24 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.004 HD11 ' HB2' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.21 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.566 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.41 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.703 ' ND2' HD21 ' A' ' -3' ' ' LEU . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 43.54 110.896 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.31 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.929 ' N ' HD13 ' A' ' 136' ' ' LEU . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 64.31 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.32 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.426 ' CD ' ' O ' ' A' ' -5' ' ' GLY . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.23 110.853 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.474 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.32 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.6 m80 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.51 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.23 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 32.1 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 62.25 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.778 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.03 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.778 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.54 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 63.51 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.14 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.33 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.1 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.23 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 51.34 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.622 ' HB2' ' CZ3' ' A' ' 87' ' ' TRP . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.41 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.847 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.11 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.34 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.708 ' HB2' HD11 ' A' ' 41' ' ' LEU . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.33 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.437 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.24 110.954 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.4 OUTLIER -73.58 148.52 87.87 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 42.51 110.844 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.445 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.8 -46.13 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.647 2.231 . . . . 51.55 112.343 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.483 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -59.33 159.51 15.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.704 0.764 . . . . 75.4 110.901 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.646 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.5 Cg_endo -69.76 -49.31 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.658 2.238 . . . . 70.43 112.321 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.646 HD22 ' HG2' ' A' ' 163' ' ' PRO . 1.8 mm? -51.6 -174.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 73.43 110.999 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.433 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.486 0 N-CA-C 110.27 -1.132 . . . . 74.43 110.27 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.524 0 N-CA-C 110.264 -1.134 . . . . 64.41 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.427 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.2 Cg_endo -69.79 -9.77 26.9 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.731 2.288 . . . . 72.54 112.309 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.541 HD23 ' SD ' ' A' ' 1' ' ' MET . 8.8 tp -35.94 153.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 72.4 110.893 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 1' ' ' MET . . . -65.63 143.75 45.96 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.709 -0.758 . . . . 74.24 112.487 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 72.6 m -55.23 84.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.05 110.886 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.541 ' SD ' HD23 ' A' ' -3' ' ' LEU . 1.9 ptm -90.84 -53.67 4.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 71.11 110.869 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.552 ' HB3' ' HG3' ' A' ' 5' ' ' GLN . . . -177.4 177.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 61.13 111.114 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -113.45 -34.47 5.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 70.42 110.843 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.472 ' O ' ' CG ' ' A' ' 9' ' ' HIS . 52.4 p -80.49 6.05 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.812 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.552 ' HG3' ' HB3' ' A' ' 2' ' ' ALA . 8.8 mt-30 -83.39 -14.0 53.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 62.51 110.927 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -53.36 162.71 1.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.606 0.717 . . . . 40.51 110.891 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -48.79 0.65 Allowed 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.704 2.269 . . . . 74.03 112.408 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD11 ' NE ' ' A' ' 142' ' ' ARG . 0.2 OUTLIER -90.8 1.7 56.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.42 110.956 179.894 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.65 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 1.4 p80 -41.65 -54.15 3.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 61.44 110.852 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.65 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.2 tp10 -73.68 -19.06 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.31 110.868 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' NE ' ' HA ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.51 110.91 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.047 HG21 HD21 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.4 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 65.52 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 63.43 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.731 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 63.14 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.4 ' HA ' HG12 ' A' ' 20' ' ' ILE . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.43 110.925 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.427 ' CG ' ' HG1' ' A' ' 35' ' ' THR . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.24 110.837 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 64.31 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.518 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.11 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.3 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.35 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.39 16.64 2.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.42 111.038 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.6 mmt-85 -114.63 112.74 23.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 75.41 110.894 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -53.01 162.59 1.0 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.596 0.712 . . . . 74.05 110.887 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -14.7 36.43 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.702 2.268 . . . . 53.22 112.356 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -94.95 5.63 51.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 63.34 110.867 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -136.05 140.98 34.74 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.652 0.739 . . . . 64.13 111.161 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 137.67 36.15 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.715 2.276 . . . . 62.41 112.341 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 1.0 OUTLIER -103.28 162.84 18.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.661 0.743 . . . . 75.11 110.852 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 160.73 48.61 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.705 2.27 . . . . 64.55 112.343 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 170.11 17.36 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.683 2.255 . . . . 64.12 112.311 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 152.8 69.01 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.716 2.277 . . . . 75.14 112.317 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.452 HG21 ' NE ' ' A' ' 14' ' ' ARG . 1.5 m -81.22 -55.71 4.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 73.44 111.141 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.542 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 1.1 t -152.59 178.21 9.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 70.14 110.859 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.607 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 54.43 111.106 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.702 ' HB2' HD22 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 53.2 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 50.11 111.115 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.4 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.13 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 65.31 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 71.34 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.449 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 64.42 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.778 HG11 ' CD2' ' A' ' 158' ' ' PHE . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 61.11 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.768 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.52 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 71.12 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 70.45 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.486 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.14 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.21 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 70.22 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.651 ' OE2' ' CE1' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.651 ' CE1' ' OE2' ' A' ' 52' ' ' GLU . 29.3 m80 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.14 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.03 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.53 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.652 ' CB ' HG21 ' A' ' 99' ' ' THR . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.13 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.51 110.794 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.2 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.42 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.14 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 53.43 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 54.31 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.15 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.594 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.4 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.653 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 64.1 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 44.13 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 62.32 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 1.023 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.23 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.633 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 52.34 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 73.2 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.34 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.893 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 44.24 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 70.23 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.955 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 64.32 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 70.24 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 44.12 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 64.52 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB2' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 51.41 110.9 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.44 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 52.3 110.946 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 53.33 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.541 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 62.51 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.11 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.976 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 72.14 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 55.2 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 61.02 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.976 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 52.42 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.03 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.432 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 73.15 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.767 HD23 ' C ' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.22 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.31 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.768 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 72.41 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.933 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.41 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.82 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 61.21 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 40.14 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.4 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.933 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 64.4 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 101' ' ' MET . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 45.23 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.435 ' O ' ' NE2' ' A' ' 103' ' ' GLN . 10.2 p30 -102.55 161.75 13.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.11 110.862 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.449 ' HA ' ' CG1' ' A' ' 120' ' ' ILE . 1.6 mm100 -133.72 -178.65 5.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 71.23 110.922 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 167.07 59.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.725 -0.75 . . . . 75.44 112.481 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.406 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 53.5 Cg_endo -69.78 -161.95 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 70.31 112.279 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.58 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.2 t80 -116.35 -9.11 11.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 74.0 110.94 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.75 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.31 90.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.067 -0.515 . . . . 75.13 110.864 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.549 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.03 -153.86 0.5 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 74.51 111.081 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.853 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -65.28 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 75.24 111.114 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.853 ' N ' HG22 ' A' ' 109' ' ' VAL . 4.0 tttt -70.76 92.44 0.88 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 64.44 110.913 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.404 ' CD ' ' H ' ' A' ' 108' ' ' ALA . 8.0 mm100 -135.5 131.63 36.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 72.51 110.906 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -64.32 -76.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.02 110.908 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 -80.8 -178.38 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 74.33 110.789 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.51 -28.97 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 74.42 110.907 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.17 -13.08 1.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 61.34 110.868 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 115' ' ' LEU . . . -36.17 113.78 0.17 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.745 -0.74 . . . . 70.22 112.532 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -140.91 127.96 20.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 74.23 110.927 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.674 ' HB3' HG23 ' A' ' 120' ' ' ILE . 26.9 mmt-85 -69.93 164.22 24.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 74.21 110.896 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.555 ' CG2' HG23 ' A' ' 122' ' ' THR . 11.5 p -75.37 -13.66 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 74.32 111.173 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.674 HG23 ' HB3' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -49.56 -22.87 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 54.21 111.076 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.633 ' H ' HD13 ' A' ' 120' ' ' ILE . 7.7 p -76.44 -53.75 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 75.24 111.152 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.628 ' N ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.32 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 73.21 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.52 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.847 ' O ' HG23 ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 62.04 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.32 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 1.023 HG12 HG21 ' A' ' 71' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.43 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 125' ' ' CYS . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 63.42 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 44.04 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.633 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.22 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.82 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 62.1 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.679 ' O ' HD23 ' A' ' 136' ' ' LEU . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.02 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 54.43 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.893 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 60.13 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 12' ' ' THR . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 51.35 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.75 ' N ' HD23 ' A' ' 136' ' ' LEU . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 63.25 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 64.34 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.33 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.461 ' CD ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.845 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.1 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.619 ' NE ' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.14 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.55 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.21 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 63.1 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.617 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.32 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.32 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.01 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.42 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.485 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.31 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CZ2' HD11 ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 64.24 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.01 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.02 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.34 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.607 ' SG ' HG12 ' A' ' 37' ' ' VAL . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 53.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.581 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.04 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.419 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.2 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.32 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.21 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -48.85 150.11 2.81 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 70.23 110.912 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.435 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -47.87 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.679 2.252 . . . . 61.02 112.312 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.494 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 4.3 mm? -59.17 160.27 12.48 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.615 0.722 . . . . 61.11 110.865 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 162' ' ' LEU . 54.0 Cg_endo -69.78 -43.81 2.42 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.601 2.201 . . . . 73.32 112.407 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 mp -48.86 171.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 70.12 110.852 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.308 -1.117 . . . . 73.22 110.308 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.478 0 N-CA-C 110.288 -1.125 . . . . 33.42 110.288 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -49.33 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.707 2.272 . . . . 74.22 112.33 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.681 HD13 ' N ' ' A' ' -2' ' ' GLY . 0.3 OUTLIER -42.59 136.63 2.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 62.54 110.915 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.681 ' N ' HD13 ' A' ' -3' ' ' LEU . . . -149.45 -144.76 4.0 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.76 . . . . 63.14 112.476 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 0' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' -2' ' ' GLY . 0.7 OUTLIER -34.54 129.78 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.909 0.385 . . . . 54.42 110.851 -179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.514 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 2.4 ptp -84.25 -49.15 9.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 60.31 110.867 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.514 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -100.02 161.85 13.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 64.4 111.122 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -134.71 3.07 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.34 110.884 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -100.79 -19.31 16.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 71.03 110.862 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -93.54 46.44 1.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 72.21 110.944 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -112.87 86.88 9.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.546 0.688 . . . . 53.24 110.844 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -90.85 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.65 2.233 . . . . 63.23 112.389 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.698 HD13 HH21 ' A' ' 142' ' ' ARG . 10.4 mp -83.28 22.05 1.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.219 -0.446 . . . . 74.23 110.932 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.646 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 5.8 p-80 -61.89 -54.12 46.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.835 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.646 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 6.3 tt0 -79.58 -34.77 40.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 64.23 110.897 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.448 ' HD2' ' N ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.15 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.977 ' CG2' HD21 ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.33 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 61.0 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.53 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' CD ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 43.52 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.665 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.32 110.958 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 61.15 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' CG ' ' CB ' ' A' ' 35' ' ' THR . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.21 110.912 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.788 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.51 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.771 HG23 ' HG3' ' A' ' 101' ' ' MET . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 73.51 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 71.34 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 63.11 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -82.54 4.95 22.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 72.15 111.067 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' C ' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -32.41 111.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.842 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.73 ' HB2' HG22 ' A' ' 29' ' ' THR . 20.5 mm-40 -49.02 149.46 3.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.612 0.72 . . . . 70.53 110.938 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -10.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 75.15 112.318 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -109.23 5.87 24.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.43 110.873 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.3 t -153.22 141.17 13.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.568 0.699 . . . . 72.35 111.143 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.65 165.34 31.17 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.641 2.228 . . . . 62.53 112.386 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' CG ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER -73.37 141.86 80.86 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.719 . . . . 65.31 110.927 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 169.61 18.59 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.69 2.26 . . . . 60.32 112.323 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 170.25 16.94 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.719 2.279 . . . . 74.22 112.368 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 136.38 32.68 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.687 2.258 . . . . 63.21 112.301 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.531 ' CG2' ' N ' ' A' ' 36' ' ' SER . 0.6 OUTLIER -70.72 -44.68 66.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 64.2 111.176 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.54 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.1 m -142.04 -177.37 5.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.22 110.883 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.402 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 65.21 111.177 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.799 ' CD ' HD22 ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.01 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.54 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.31 111.108 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 50.22 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.863 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.1 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.056 HD13 HD23 ' A' ' 94' ' ' LEU . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.31 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 70.12 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.438 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.41 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.639 HG13 ' O ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 51.52 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.788 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 64.43 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 74.33 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.13 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.493 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.23 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.515 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.03 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.613 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 43.3 m80 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 73.21 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.43 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.22 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.34 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.41 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.907 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.12 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.01 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 44.41 110.832 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 65.23 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 55.23 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.401 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.21 110.878 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.34 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 71.34 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.752 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 61.34 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 70.23 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.24 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 53.34 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.843 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 64.32 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.1 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.53 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.838 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 73.2 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.659 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.44 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.01 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.921 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 60.52 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.921 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.13 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.907 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.14 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.459 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.51 110.847 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 55.43 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.21 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.517 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 60.41 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.33 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.619 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 71.15 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 71.13 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.41 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 62.21 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.619 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.844 HG12 HD23 ' A' ' 42' ' ' LEU . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.04 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.424 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.3 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.82 HD11 HD22 ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 45.01 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.056 HD23 HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 72.33 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 53.52 111.126 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.934 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 73.03 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.117 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 53.23 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.44 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.667 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.11 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.934 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.771 ' HG3' HG23 ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 60.0 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.403 ' OD1' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER -86.94 161.34 18.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.33 110.904 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.581 ' OE1' HD11 ' A' ' 120' ' ' ILE . 11.7 mm100 -140.05 70.02 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 64.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.97 70.23 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.806 -0.712 . . . . 74.55 112.553 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.528 ' HB2' ' CD1' ' A' ' 106' ' ' TYR . 53.4 Cg_endo -69.71 -162.71 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.692 2.261 . . . . 74.33 112.326 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.695 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.38 -83.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 73.15 110.944 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.7 ' H ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -152.24 -157.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 65.43 110.883 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -140.82 108.25 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 65.31 111.134 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.621 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.0 p -156.14 -51.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 73.3 111.165 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.621 ' N ' HG13 ' A' ' 109' ' ' VAL . 7.3 mttt -94.49 78.74 3.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 71.42 110.863 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.781 ' OE1' HD21 ' A' ' 115' ' ' LEU . 34.2 mm-40 -136.04 122.07 20.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 73.3 110.946 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.415 ' C ' ' HG2' ' A' ' 113' ' ' ARG . 6.4 mmpt? -83.7 34.08 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.447 . . . . 75.31 110.919 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 112' ' ' LYS . 15.2 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 75.13 110.904 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -108.12 -58.53 1.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 73.32 110.859 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.781 HD21 ' OE1' ' A' ' 111' ' ' GLN . 0.1 OUTLIER -56.63 -13.04 2.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 72.14 110.935 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.65 -110.69 3.39 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.825 -0.702 . . . . 63.34 112.47 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -80.66 176.16 10.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 62.12 110.889 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.711 ' HB3' HD12 ' A' ' 120' ' ' ILE . 4.8 mmp_? -44.38 138.47 3.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 73.34 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.559 ' HA ' HG22 ' A' ' 122' ' ' THR . 0.5 OUTLIER -76.58 -11.41 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 63.41 111.131 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.903 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -66.74 -31.01 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 55.42 111.081 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.903 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.5 OUTLIER -76.46 -42.11 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.11 111.158 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 119' ' ' VAL . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.44 111.149 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.32 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.14 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 61.12 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.31 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 70.54 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.872 HD11 HD12 ' A' ' 100' ' ' LEU . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 62.22 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 125' ' ' CYS . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.04 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.53 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.12 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.117 HD11 ' HB2' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.54 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.496 ' CE1' ' O ' ' A' ' 9' ' ' HIS . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.54 110.926 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 64.43 110.904 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.659 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 53.22 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.977 HD21 ' CG2' ' A' ' 12' ' ' THR . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 60.22 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.54 ' N ' HD12 ' A' ' 136' ' ' LEU . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.23 110.912 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.43 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.432 ' CB ' ' HE ' ' A' ' 140' ' ' ARG . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.44 110.9 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 63.21 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.598 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 71.02 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.698 HH21 HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.41 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.42 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 54.33 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.852 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.05 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.54 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 53.04 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 24.12 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CD1' HD23 ' A' ' 8' ' ' LEU . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.52 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.31 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 61.31 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 71.34 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.728 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.31 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.574 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.408 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 62.02 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HB2' HD11 ' A' ' 41' ' ' LEU . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.01 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 64.33 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.427 ' CG ' ' HD2' ' A' ' 161' ' ' PRO . 2.7 t30 -65.38 140.06 97.59 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 55.14 110.901 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.72 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.643 2.228 . . . . 72.12 112.385 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.484 HD13 ' HD2' ' A' ' 163' ' ' PRO . 1.3 mm? -67.02 141.36 96.55 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.643 0.735 . . . . 70.12 110.943 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.484 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.6 Cg_endo -69.78 -51.02 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.676 2.251 . . . . 71.14 112.281 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.7 mp -86.98 -173.31 4.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 71.13 110.946 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.31 -1.116 . . . . 51.15 110.31 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.56 0 N-CA-C 110.251 -1.139 . . . . 61.11 110.251 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 0.08 6.11 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.686 2.257 . . . . 74.32 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.723 HD22 ' CZ ' ' A' ' 139' ' ' ARG . 5.8 tt -65.39 115.83 6.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 63.43 110.999 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -57.49 -158.13 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.777 -0.725 . . . . 45.31 112.516 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -107.82 134.95 50.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.959 0.409 . . . . 72.54 110.788 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.436 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 26.1 ptm -90.74 -52.83 4.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 73.33 110.896 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.667 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -133.8 178.53 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 65.51 111.087 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.9 -32.31 3.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 73.44 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -23.63 10.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 62.3 110.839 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.667 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 59.4 mm-40 -40.98 -40.09 1.33 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 62.41 110.872 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.04 86.76 9.56 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.547 0.689 . . . . 60.12 110.908 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.05 3.92 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.665 2.244 . . . . 61.31 112.321 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.61 HD13 HH21 ' A' ' 142' ' ' ARG . 2.1 mt -66.72 -4.06 8.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 73.23 110.897 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 35.8 m170 -61.45 -77.04 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 72.43 110.93 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 -51.76 -16.62 0.71 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 60.44 110.844 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.23 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.103 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.43 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.22 110.925 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 70.33 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.24 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.891 ' HB3' HG13 ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.402 ' HA ' HG12 ' A' ' 20' ' ' ILE . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 42.11 110.874 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.757 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 64.25 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' SD ' ' A' ' 101' ' ' MET . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 53.04 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.633 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.24 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.55 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.08 17.03 10.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 62.43 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.471 ' HD2' ' CD ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -114.24 112.97 23.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.443 . . . . 73.34 110.883 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' ARG . 8.0 mt-10 -35.2 149.65 0.1 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.71 0.767 . . . . 74.13 110.901 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -20.38 35.08 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.622 2.214 . . . . 62.24 112.429 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -75.66 5.51 6.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 64.02 110.861 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 t -143.0 141.13 18.92 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.672 0.749 . . . . 53.21 111.104 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 137.33 35.19 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.715 2.277 . . . . 64.44 112.31 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.541 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -86.38 151.46 53.6 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.624 0.726 . . . . 64.42 110.882 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.471 ' CD ' ' HD2' ' A' ' 25' ' ' ARG . 53.7 Cg_endo -69.79 170.38 16.74 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.64 2.227 . . . . 63.31 112.323 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 170.19 17.21 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.714 2.276 . . . . 75.23 112.283 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' HG3' ' CB ' ' A' ' 40' ' ' ALA . 53.4 Cg_endo -69.78 -174.48 0.92 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.713 2.275 . . . . 62.3 112.32 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.28 -36.54 4.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 54.4 111.177 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.613 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -133.88 -178.69 5.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.805 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.41 111.145 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.848 ' O ' HD22 ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.15 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.613 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.4 111.058 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.451 ' CB ' ' HG3' ' A' ' 34' ' ' PRO . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.13 111.12 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.741 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 62.33 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 50.12 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.89 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 63.41 110.922 -179.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.684 HG11 ' HD2' ' A' ' 158' ' ' PHE . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 71.04 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.757 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.04 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.625 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 65.52 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.55 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.24 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 57.8 m80 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.24 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.7 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.15 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.03 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 64.41 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.34 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 53.43 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.14 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 63.33 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 64.32 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.23 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.453 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 62.13 110.864 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 61.42 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.941 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.34 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.75 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 60.33 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 55.23 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.941 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.31 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.637 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.24 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.35 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.44 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.796 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.32 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.779 ' HB1' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 41.41 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.44 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.895 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.45 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 43.51 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 62.44 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.42 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.31 110.885 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.566 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.54 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 53.11 110.826 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.555 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.11 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 64.5 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.751 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 70.31 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 1.075 ' CZ3' HD12 ' A' ' 90' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.23 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 72.13 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.12 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.075 HD12 ' CZ3' ' A' ' 87' ' ' TRP . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 71.23 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.817 HG12 HD11 ' A' ' 42' ' ' LEU . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 63.34 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.625 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.33 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.491 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.32 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.52 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.569 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 71.1 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.015 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.4 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.14 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 74.43 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.925 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.32 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.791 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 54.44 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.0 161.21 13.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 54.42 110.971 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.49 ' OE1' ' CG ' ' A' ' 101' ' ' MET . 2.3 mm100 -129.39 106.41 8.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 72.25 110.894 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.504 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -151.92 49.51 0.53 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.765 -0.731 . . . . 40.21 112.465 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.504 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.2 Cg_endo -69.78 -162.94 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.697 2.265 . . . . 74.44 112.322 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.529 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -124.36 -13.57 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.859 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.438 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -39.13 95.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 71.1 110.863 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.487 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -100.15 -151.52 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 72.1 111.106 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.848 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.37 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.12 111.117 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.848 ' N ' HG22 ' A' ' 109' ' ' VAL . 1.2 mtpt -68.44 90.79 0.38 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.19 -0.459 . . . . 64.45 110.919 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.487 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 21.3 mm-40 -143.09 119.16 10.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 70.45 110.931 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.76 65.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 75.0 110.913 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -119.07 173.84 6.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.3 110.922 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.18 -55.45 0.98 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.242 -0.435 . . . . 71.0 110.892 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.88 -65.25 0.65 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 61.01 110.952 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 138.37 -45.07 1.07 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.767 -0.73 . . . . 40.2 112.517 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -154.8 116.5 4.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 60.2 110.881 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.778 ' HA ' HG13 ' A' ' 121' ' ' VAL . 36.8 ptt85 -153.47 15.24 0.51 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 74.44 110.892 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.4 t -78.9 -68.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 61.52 111.158 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.908 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -85.25 -31.08 6.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 75.11 111.112 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.908 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -64.54 -40.66 89.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 63.12 111.144 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.56 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 55.43 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.555 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.41 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.6 ' HA ' HD21 ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.13 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.743 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 60.24 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.22 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.965 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 64.34 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.965 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.31 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.891 HG13 ' HB3' ' A' ' 16' ' ' LEU . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 51.33 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 63.44 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.015 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 73.51 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.514 ' CE2' ' HB2' ' A' ' 13' ' ' ARG . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.33 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.779 ' CD1' ' HB1' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 71.24 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.103 HD11 HG21 ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 70.23 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.32 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.31 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.723 ' CZ ' HD22 ' A' ' -3' ' ' LEU . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 62.02 110.892 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.566 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 62.11 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.723 ' NH1' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 61.21 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.54 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.85 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.03 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.809 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.34 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.44 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.665 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.34 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.03 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 34.13 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 64.55 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.1 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 51.1 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.639 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.13 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.741 ' HA ' HD23 ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.53 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.556 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.22 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HD2' HG11 ' A' ' 45' ' ' VAL . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 63.35 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.575 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.27 167.48 0.19 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.14 110.933 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.6 Cg_endo -69.73 -50.08 0.5 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.708 2.272 . . . . 72.21 112.297 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.405 ' O ' ' ND2' ' A' ' 160' ' ' ASN . 0.7 OUTLIER -105.72 118.49 55.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.608 0.718 . . . . 60.33 110.91 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.76 -38.25 8.04 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.268 . . . . 65.42 112.305 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.492 ' O ' HD23 ' A' ' 164' ' ' LEU . 0.3 OUTLIER -76.38 177.01 7.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 74.31 110.887 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.264 -1.134 . . . . 51.31 110.264 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.554 0 N-CA-C 110.259 -1.136 . . . . 25.35 110.259 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.555 ' O ' HD22 ' A' ' -3' ' ' LEU . 53.6 Cg_endo -69.74 -20.16 35.29 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.666 2.244 . . . . 64.42 112.344 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' -4' ' ' PRO . 2.6 mm? -122.96 -14.83 7.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 74.24 110.886 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 115.32 -173.87 14.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.695 -0.764 . . . . 70.22 112.446 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.1 t -91.04 118.36 30.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 72.51 110.887 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.1 ttt -90.89 -46.15 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 73.31 110.886 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.7 176.71 6.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 72.54 111.121 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.4 -39.48 16.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.426 . . . . 72.23 110.921 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.9 m -81.38 14.9 2.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 73.33 110.833 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -84.18 63.17 7.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 61.01 110.957 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.97 159.96 1.68 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.581 0.705 . . . . 70.13 110.907 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -91.03 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.727 2.285 . . . . 71.31 112.407 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.925 HD12 ' NE1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -113.36 5.77 16.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 61.11 110.918 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.491 ' N ' HD23 ' A' ' 8' ' ' LEU . 40.2 t-80 -43.1 -79.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.881 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -62.19 -15.24 45.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.895 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.21 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.646 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.41 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 53.14 110.919 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.13 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.829 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.842 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.459 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.14 110.842 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.553 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.24 110.864 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.764 ' CE1' HG21 ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 54.34 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.885 HG22 ' SD ' ' A' ' 101' ' ' MET . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 60.32 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.24 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 55.41 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . -81.85 17.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.2 111.044 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' CA ' ' NE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -112.59 112.75 24.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 72.2 110.908 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -39.07 154.62 0.15 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.66 0.743 . . . . 65.01 110.877 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 -8.43 23.58 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.699 2.266 . . . . 62.43 112.38 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.12 5.63 49.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 72.45 110.817 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.83 140.8 16.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 75.44 111.096 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 137.84 36.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.717 2.278 . . . . 74.51 112.33 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -74.84 156.84 86.24 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.694 0.759 . . . . 71.03 110.892 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 170.11 17.29 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.699 2.266 . . . . 73.53 112.386 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 170.27 16.95 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.632 2.221 . . . . 71.53 112.341 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -167.58 0.24 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.633 2.222 . . . . 61.31 112.358 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.553 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -131.58 -53.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 61.35 111.078 -179.935 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.524 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.9 m -124.05 -176.25 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.275 -0.421 . . . . 45.5 110.875 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.609 HG11 ' CA ' ' A' ' 165' ' ' GLY . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.21 111.077 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.614 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.14 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.524 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 61.45 111.097 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.41 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.944 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.24 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.003 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.21 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.43 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.24 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.687 HG23 ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 72.21 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 51.34 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.575 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 73.3 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.15 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.53 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.33 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.623 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.33 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 70.11 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.14 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 63.42 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 62.41 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.32 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.22 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 71.44 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 61.45 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.44 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.451 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.33 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 54.44 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.81 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.23 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 71.12 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.14 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.44 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 54.55 110.923 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.96 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 44.32 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.703 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 62.02 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.33 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.853 ' HG3' HD23 ' A' ' 78' ' ' LEU . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 43.31 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.86 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.23 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.86 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 61.4 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.41 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 60.35 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 43.43 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.734 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 70.12 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.14 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.81 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.53 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.44 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 1.073 ' CE3' HD12 ' A' ' 90' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.44 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' MET . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.11 110.838 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.506 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 24.6 mm-40 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.13 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.073 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.22 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.785 HG11 ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.33 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.575 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 63.24 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.835 HD11 ' HB2' ' A' ' 75' ' ' ALA . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.42 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.003 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.11 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.789 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.24 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 1.004 ' CE2' HD11 ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.23 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.025 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.15 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.23 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.633 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.41 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.004 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 61.33 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.885 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 62.23 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.489 ' N ' ' O ' ' A' ' 100' ' ' LEU . 4.4 p30 -69.24 146.19 52.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 74.2 110.847 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -147.37 82.04 1.53 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 54.51 110.867 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.93 58.57 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.757 -0.735 . . . . 43.25 112.472 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.442 ' HB3' ' CG2' ' A' ' 120' ' ' ILE . 53.9 Cg_endo -69.74 -163.13 0.1 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.717 2.278 . . . . 51.12 112.322 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.617 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.36 -29.57 3.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 65.21 110.921 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.541 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 15.3 mmt -36.1 92.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.501 . . . . 53.3 110.885 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.84 19.4 20.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.347 -0.388 . . . . 73.5 111.087 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.622 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.3 p -91.08 -52.07 10.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 51.14 111.11 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.622 ' N ' HG13 ' A' ' 109' ' ' VAL . 1.3 mtpt -116.15 76.91 1.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 64.31 110.934 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.28 134.46 55.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 54.31 110.891 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -163.24 -177.27 5.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 54.33 110.921 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.9 43.36 2.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.1 110.888 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -133.74 -65.2 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 64.4 110.894 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.606 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -60.81 -11.91 9.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 75.25 110.872 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.403 ' O ' ' O ' ' A' ' 117' ' ' ASN . . . 61.52 150.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.732 -0.747 . . . . 62.11 112.503 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.474 HD22 HG11 ' A' ' 121' ' ' VAL . 0.6 OUTLIER -47.84 -98.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.82 0.343 . . . . 63.11 110.863 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.76 ' HA ' HG13 ' A' ' 121' ' ' VAL . 26.8 mtt180 62.91 5.9 1.99 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 71.52 110.877 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.774 HG13 ' H ' ' A' ' 120' ' ' ILE . 1.3 p -76.38 -66.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 74.01 111.143 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.774 ' H ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -84.77 -34.18 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 74.55 111.125 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.76 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.51 -43.34 94.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 73.24 111.143 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 72.25 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.415 ' N ' HG23 ' A' ' 122' ' ' THR . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.11 110.899 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.04 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.687 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 71.55 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.24 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 64.25 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.96 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.41 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.842 HG13 ' HB3' ' A' ' 16' ' ' LEU . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 74.4 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.562 ' O ' ' ND2' ' A' ' 134' ' ' ASN . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 70.44 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.025 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.4 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.599 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 60.15 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.647 HD22 ' HA ' ' A' ' 131' ' ' PHE . 11.1 p30 -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.42 110.824 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.735 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 64.13 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.04 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.53 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.05 112.492 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.42 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 64.31 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.518 ' NH2' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.42 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.646 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 61.01 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.43 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.812 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.22 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.793 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 64.42 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.24 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 42.21 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 62.24 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.449 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 54.05 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.925 ' NE1' HD12 ' A' ' 8' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.23 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.12 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.02 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.944 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.11 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.722 ' HA ' HD12 ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.15 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.692 ' HB2' HD11 ' A' ' 41' ' ' LEU . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.44 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 71.32 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 4.3 t-20 -65.57 143.15 98.56 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.51 110.918 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.407 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -46.01 1.35 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.672 2.248 . . . . 74.22 112.361 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.468 HD22 ' CB ' ' A' ' 40' ' ' ALA . 4.5 mp -64.2 161.03 44.18 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.638 0.732 . . . . 73.13 110.907 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.589 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.9 Cg_endo -69.78 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 54.24 112.415 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.589 HD22 ' HG2' ' A' ' 163' ' ' PRO . 2.3 mm? -51.47 -174.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 72.23 110.95 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.609 ' CA ' HG11 ' A' ' 37' ' ' VAL . . . . . . . . 0 C--N 1.335 0.522 0 N-CA-C 110.287 -1.125 . . . . 73.0 110.287 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 N-CA-C 110.28 -1.128 . . . . 71.31 110.28 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -38.31 8.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.724 2.282 . . . . 62.1 112.304 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 0' ' ' SER . 9.5 mt -100.44 -64.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.855 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.445 ' C ' ' O ' ' A' ' -3' ' ' LEU . . . 34.53 -93.27 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.819 -0.705 . . . . 72.22 112.391 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 0' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' -3' ' ' LEU . 90.0 p -144.35 105.63 4.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 75.23 110.906 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 tpt -56.67 -35.64 68.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.14 110.902 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.15 171.69 17.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 54.33 111.086 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -74.15 3.7 6.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.15 110.834 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 6' ' ' ASP . 14.8 t -95.17 -8.1 37.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.54 110.848 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' SER . 28.2 mm-40 -36.48 -31.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 72.13 110.889 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.4 OUTLIER -105.46 91.04 4.47 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.574 0.702 . . . . 64.02 110.899 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.476 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.1 Cg_endo -69.76 -2.13 9.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.69 2.26 . . . . 71.14 112.339 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.464 HD22 HH21 ' A' ' 142' ' ' ARG . 0.3 OUTLIER -112.8 -16.47 12.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.244 -0.435 . . . . 71.23 110.936 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.541 ' CE1' ' OH ' ' A' ' 133' ' ' TYR . 5.6 t60 -63.86 -76.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 54.41 110.851 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' O ' ' CD ' ' A' ' 10' ' ' GLU . 15.1 tm-20 -57.22 -12.71 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.917 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.21 110.874 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.91 HG21 HD11 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.03 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.52 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.24 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.788 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.52 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.35 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.43 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' CE1' HG21 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.33 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.886 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 71.1 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.33 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.639 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.01 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . -83.88 17.17 2.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.35 111.075 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 47.6 mmt-85 -111.9 112.66 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.922 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -37.68 155.6 0.1 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.62 0.724 . . . . 74.04 110.902 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -10.76 29.34 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.621 2.214 . . . . 63.22 112.389 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -90.42 5.57 46.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.254 -0.43 . . . . 75.31 110.864 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.54 141.18 18.48 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.52 0.676 . . . . 72.2 111.185 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 137.09 34.82 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.656 2.237 . . . . 64.13 112.37 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -79.88 157.62 73.8 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 70.24 110.868 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 169.29 19.27 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.721 2.281 . . . . 60.21 112.336 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 170.0 17.58 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.696 2.264 . . . . 72.53 112.358 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.09 39.61 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.797 2.331 . . . . 62.14 112.267 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -97.85 -44.58 6.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 74.52 111.18 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.611 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 70.3 m -137.93 -177.8 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 72.14 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 51.43 111.145 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.739 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 73.53 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.611 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.05 111.121 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 61.14 111.157 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.816 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.431 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 70.5 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.762 HG11 ' CD2' ' A' ' 158' ' ' PHE . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 71.24 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.733 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.32 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.33 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.2 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.03 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.511 HD13 ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.24 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.32 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.35 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.605 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.01 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.31 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.13 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.605 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.1 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 72.53 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 62.05 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 61.2 110.886 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.22 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.55 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 63.05 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.31 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.32 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.784 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 72.45 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.44 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 63.41 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.658 ' N ' HD23 ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.35 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.902 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 72.44 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.54 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.35 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.634 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.11 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.875 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 52.22 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 70.02 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.868 ' HG3' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 55.01 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.928 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.41 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.928 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.32 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.34 110.838 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HB2' ' CZ ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 64.4 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.3 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.453 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 55.4 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.891 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.43 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.12 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.721 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.34 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.24 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.43 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.891 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.41 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.75 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.53 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 65.31 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.875 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.43 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD13 ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 73.04 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.733 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.52 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 1.001 ' CE2' HD11 ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.35 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.045 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.45 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.545 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.32 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.641 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 61.55 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.001 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 63.15 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.886 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.04 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -87.88 161.14 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.32 110.955 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.45 ' OE1' ' HB1' ' A' ' 24' ' ' ALA . 7.1 mm100 -143.31 145.03 32.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 74.15 110.922 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.0 58.93 0.15 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.762 -0.732 . . . . 43.53 112.48 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.63 -163.31 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 72.22 112.32 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.0 OUTLIER -125.52 -76.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 75.03 110.9 -179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.559 ' N ' ' CG ' ' A' ' 106' ' ' TYR . 30.0 mmt -112.61 71.82 0.75 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 63.3 110.796 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.17 92.8 5.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 73.42 111.082 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.569 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.5 p -146.69 -51.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 64.13 111.151 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.569 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.1 OUTLIER -95.51 77.81 3.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 74.14 110.934 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.478 ' HA ' HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -136.16 71.63 1.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 74.45 110.864 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -101.17 93.7 5.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 62.43 110.854 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.44 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.7 OUTLIER 34.84 37.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 65.34 110.893 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.443 ' C ' ' OD1' ' A' ' 114' ' ' ASP . 4.2 t0 -113.08 -67.27 1.01 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 64.35 110.868 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.795 HD23 ' H ' ' A' ' 115' ' ' LEU . 2.7 pt? -102.34 -36.18 8.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.25 110.915 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.463 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 50.58 101.88 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 75.3 112.433 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.463 ' C ' ' O ' ' A' ' 116' ' ' GLY . 6.8 p-10 -33.42 112.43 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 51.23 110.834 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.73 ' HA ' HG13 ' A' ' 121' ' ' VAL . 8.0 ptt180 -142.97 28.97 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.478 . . . . 72.52 110.867 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.61 -69.45 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.35 111.072 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.816 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -87.24 -40.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 64.44 111.143 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.816 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -51.0 -35.94 15.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 63.54 111.114 179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.11 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.536 ' O ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.02 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.13 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.792 ' O ' HG23 ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.3 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.23 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 123' ' ' ARG . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.902 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.941 HD11 HD12 ' A' ' 100' ' ' LEU . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 61.03 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 125' ' ' CYS . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.03 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 71.52 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.045 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.22 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.568 ' O ' HD12 ' A' ' 136' ' ' LEU . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.13 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 60.01 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.501 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 64.14 110.887 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.91 HD11 HG21 ' A' ' 12' ' ' THR . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 60.42 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.1 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 71.35 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.52 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 64.34 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.501 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 25.8 m80 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 70.11 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 54.34 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.492 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.13 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.522 ' NH2' ' HB1' ' A' ' 147' ' ' ALA . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.54 110.791 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.815 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 62.04 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.739 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 52.44 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.522 ' HB1' ' NH2' ' A' ' 144' ' ' ARG . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 55.01 111.142 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.721 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 60.35 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 64.24 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 72.34 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.52 ' CH2' HD22 ' A' ' 136' ' ' LEU . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.34 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.35 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 73.14 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.75 ' CE1' HG11 ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 62.25 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.493 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 55.02 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.58 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 62.5 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 53.31 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.816 ' CB ' HD11 ' A' ' 41' ' ' LEU . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.44 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.23 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.712 ' HB2' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -50.78 152.85 3.24 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.21 110.842 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.466 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.76 -49.8 0.53 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.605 2.203 . . . . 74.45 112.401 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.515 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -58.55 160.78 9.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.59 0.71 . . . . 75.2 110.969 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.5 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.8 Cg_endo -69.7 -90.36 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.646 2.231 . . . . 70.1 112.331 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.419 ' O ' ' C ' ' A' ' 165' ' ' GLY . 1.7 mp -99.02 177.25 5.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 65.21 110.942 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.336 0.528 0 N-CA-C 110.295 -1.122 . . . . 64.02 110.295 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 110.308 -1.117 . . . . 44.44 110.308 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.6 Cg_endo -69.78 -11.63 31.2 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.738 2.292 . . . . 73.14 112.296 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.446 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.8 OUTLIER -34.39 102.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 72.13 110.872 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 174.07 170.93 37.96 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 74.34 112.467 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.4 p -166.91 133.06 2.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 63.1 110.855 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ptp -89.8 -48.16 7.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 65.13 110.83 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.61 156.07 20.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 70.13 111.137 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -111.91 -50.13 2.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.05 110.883 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 t -150.21 78.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 65.2 110.891 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.49 ' NE2' ' OD2' ' A' ' 6' ' ' ASP . 3.5 pm0 -105.56 -5.26 20.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 51.02 110.923 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.496 ' CB ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -112.63 169.63 6.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.553 0.692 . . . . 75.01 110.896 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.496 ' HD2' ' CB ' ' A' ' 6' ' ' ASP . 54.2 Cg_endo -69.78 -166.76 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.709 2.273 . . . . 55.13 112.3 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.673 HD12 ' C ' ' A' ' 8' ' ' LEU . 2.7 pp -69.85 -16.96 63.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.1 110.971 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -60.76 -67.29 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 65.23 110.855 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -55.04 -22.54 16.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 70.21 110.948 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.818 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.34 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 73.41 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.493 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.859 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 62.41 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 65.32 110.842 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.424 ' CG ' HG21 ' A' ' 35' ' ' THR . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 25.21 110.825 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 70.42 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.568 HG21 ' CB ' ' A' ' 125' ' ' CYS . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.22 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 71.41 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.638 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.21 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.41 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.59 ' CB ' HG21 ' A' ' 121' ' ' VAL . . . -82.08 17.14 1.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.12 111.097 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 7.2 mtp180 -113.35 114.7 27.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 73.15 110.933 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -33.14 149.31 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.66 0.743 . . . . 63.24 110.856 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.91 29.85 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.69 2.26 . . . . 72.22 112.386 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.1 5.62 32.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 74.44 110.844 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.3 t -139.47 140.54 25.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.653 0.739 . . . . 64.34 111.104 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 137.17 35.08 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.761 2.307 . . . . 72.33 112.341 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -80.88 157.22 71.9 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.632 0.73 . . . . 73.42 110.839 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 169.99 17.7 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.612 2.208 . . . . 63.24 112.338 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 170.21 17.07 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.677 2.251 . . . . 71.11 112.351 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 165.38 31.11 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.712 2.275 . . . . 75.31 112.382 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.474 HG23 ' CB ' ' A' ' 39' ' ' ALA . 0.4 OUTLIER -99.28 -46.43 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 65.35 111.139 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.611 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -138.28 -176.04 4.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 61.42 110.854 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.566 HG23 ' OXT' ' A' ' 165' ' ' GLY . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 72.31 111.197 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.673 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.11 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.611 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.2 111.124 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 53.13 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.836 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 62.22 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.82 HD11 HG12 ' A' ' 91' ' ' VAL . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 72.35 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 65.13 110.875 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.32 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.773 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 72.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.771 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.32 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 43.02 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.566 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.33 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.566 HD13 ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.12 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.02 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 53.13 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.561 ' OE2' ' CE1' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.34 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 44.0 m80 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.55 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.31 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.02 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.45 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.12 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 54.24 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.963 ' CE1' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.11 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 71.5 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.02 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 70.22 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.44 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 14.54 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.33 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.673 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.12 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.655 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.2 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.963 HD23 ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.31 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.701 HG23 ' CD1' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.22 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.24 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.681 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 70.02 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 60.42 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.888 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.22 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.942 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 63.4 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.21 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.51 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.42 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.34 110.861 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.451 ' N ' ' OE1' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.32 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.21 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.801 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.23 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.32 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.704 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 72.34 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.801 HD21 ' CD2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 64.2 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.82 HG12 HD11 ' A' ' 42' ' ' LEU . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.03 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.02 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.666 HD11 HD22 ' A' ' 132' ' ' LEU . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.42 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.803 HD12 ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.32 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.771 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 52.13 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.828 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 71.11 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.111 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 54.53 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.24 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.663 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.52 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.839 HD12 HD11 ' A' ' 128' ' ' ILE . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 71.32 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.24 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -80.4 158.07 26.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.31 110.882 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -152.56 130.4 11.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.956 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.539 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -156.38 46.8 0.5 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 73.11 112.499 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.1 Cg_endo -69.8 -163.69 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.64 2.227 . . . . 63.23 112.328 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.484 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -124.77 -68.12 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 74.04 110.901 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.74 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.25 73.62 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 54.34 110.869 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.77 76.52 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 42.52 111.123 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.624 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.3 p -137.25 -50.55 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 44.5 111.095 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.624 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.1 mtmt -97.68 77.07 2.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.916 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -134.4 147.41 50.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 63.25 110.902 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.441 ' HG2' ' CB ' ' A' ' 114' ' ' ASP . 19.8 ttpt -64.29 -6.27 6.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 65.11 110.914 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.432 ' HD2' ' C ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER 41.59 40.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 73.4 110.912 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.441 ' CB ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -100.92 -63.82 1.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 75.41 110.891 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -62.72 -8.45 6.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.931 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 137.16 -141.14 12.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.737 -0.744 . . . . 63.34 112.492 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -103.02 -38.06 7.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.807 0.337 . . . . 71.3 110.89 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.86 ' O ' HG22 ' A' ' 122' ' ' THR . 18.3 mmm180 -154.61 176.13 12.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 75.4 110.867 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.571 HG13 ' N ' ' A' ' 120' ' ' ILE . 9.1 p -78.76 -49.33 20.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 61.43 111.154 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.571 ' N ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -62.81 -36.38 75.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 65.01 111.109 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.668 HG12 ' HB2' ' A' ' 118' ' ' ARG . 6.7 p -68.2 -54.29 23.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 63.24 111.114 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.86 HG22 ' O ' ' A' ' 118' ' ' ARG . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.12 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.14 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.543 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.12 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.938 HD12 ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 61.35 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.938 ' N ' HD12 ' A' ' 127' ' ' LEU . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.22 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.44 110.911 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.111 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.582 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.35 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.34 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.535 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.3 110.93 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.595 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.01 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.595 ' HE2' HD12 ' A' ' 136' ' ' LEU . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.22 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.21 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.4 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.501 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 71.2 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 70.42 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 64.44 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 72.54 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 72.51 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.816 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.13 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.741 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.1 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.34 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.704 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.03 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.45 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.41 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.453 ' HZ2' HD11 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.24 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.53 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 63.4 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.23 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.562 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.41 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 73.0 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.836 ' CB ' HD11 ' A' ' 41' ' ' LEU . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.41 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 53.13 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.611 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.1 t30 -53.48 139.88 47.51 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 65.03 110.888 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -46.4 1.21 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.727 2.285 . . . . 64.32 112.324 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.421 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 1.2 mm? -88.25 136.81 31.4 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.57 0.7 . . . . 73.22 110.89 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.81 -51.28 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.642 2.228 . . . . 63.15 112.343 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -85.06 -168.36 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 72.13 110.946 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.566 ' OXT' HG23 ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 75.22 110.27 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.289 -1.124 . . . . 12.13 110.289 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.48 ' O ' ' C ' ' A' ' -3' ' ' LEU . 54.5 Cg_endo -69.8 -52.02 0.35 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.669 2.246 . . . . 74.44 112.343 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.48 ' C ' ' O ' ' A' ' -4' ' ' PRO . 5.3 tp 31.63 53.36 0.23 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 63.13 110.914 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 167.2 159.79 13.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 52.22 112.448 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.5 m -171.94 121.79 0.48 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.816 0.341 . . . . 70.14 110.836 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.433 ' HG2' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER -89.64 -39.97 12.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 75.03 110.91 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.433 ' N ' ' HG2' ' A' ' 1' ' ' MET . . . -123.97 164.65 18.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 71.43 111.067 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -126.38 -65.76 0.96 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 71.14 110.9 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 t -137.77 94.77 2.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.23 110.871 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -64.67 -43.82 92.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 71.31 110.914 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -86.82 156.39 55.5 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.6 0.714 . . . . 71.5 110.859 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -38.28 8.05 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.725 2.283 . . . . 74.13 112.368 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.798 HD23 ' C ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -104.7 6.85 34.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 75.35 110.97 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.649 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 4.8 t60 -54.61 -72.76 0.06 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.135 -0.484 . . . . 74.02 110.87 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.649 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 81.5 tt0 -59.74 -14.91 16.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 71.42 110.861 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.31 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 1.039 HG21 HD21 ' A' ' 136' ' ' LEU . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.04 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 73.22 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 70.11 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.739 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 53.54 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 44.21 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.458 ' HA ' HG21 ' A' ' 129' ' ' VAL . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.23 110.868 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 73.45 110.845 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 46' ' ' THR . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 64.25 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.525 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 62.24 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.51 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.12 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.86 17.08 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.41 111.121 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.489 ' NE ' ' HD3' ' A' ' 32' ' ' PRO . 40.8 mtt85 -113.59 112.69 23.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 63.23 110.808 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 25' ' ' ARG . 9.1 mt-10 -37.9 153.76 0.13 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.639 0.733 . . . . 70.44 110.862 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 -9.66 26.67 Favored 'Trans proline' 0 C--O 1.231 0.126 0 C-N-CA 122.709 2.272 . . . . 72.41 112.335 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -89.74 5.51 45.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.907 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 t -139.02 139.16 22.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.554 0.692 . . . . 72.41 111.141 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 136.18 32.35 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.73 2.287 . . . . 73.55 112.326 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 0.7 OUTLIER -83.38 156.32 65.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.674 0.749 . . . . 65.21 110.885 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.489 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.5 Cg_endo -69.74 167.61 23.91 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 75.22 112.283 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 170.1 17.37 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.763 2.309 . . . . 71.51 112.352 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 178.89 4.06 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.711 2.274 . . . . 74.22 112.361 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.84 -43.01 2.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 62.01 111.132 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.506 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 93.3 p -136.44 -174.94 3.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 65.31 110.917 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.435 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 64.22 111.122 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.736 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.42 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.506 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 72.13 111.073 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.22 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.88 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.32 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.673 HG23 ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.872 ' HB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.44 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.02 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.552 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.552 HD13 ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.33 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 62.52 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.3 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.495 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 62.54 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 47.5 m80 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.41 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 64.33 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 71.41 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.42 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.11 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 54.44 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.42 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.42 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 63.14 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.03 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.845 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.21 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.74 ' O ' HD13 ' A' ' 100' ' ' LEU . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.32 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.34 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 54.44 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.983 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 71.32 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.43 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.5 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.709 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.21 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.909 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 53.12 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.23 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.858 ' HG2' HD23 ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 52.44 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.913 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.53 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.913 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 70.51 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.768 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.34 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 53.24 110.83 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.506 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.2 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 60.45 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.15 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.44 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.899 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 73.21 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 54.21 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.899 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 71.34 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.548 HG11 ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 64.54 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.433 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.12 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.13 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.762 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.13 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.984 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 64.42 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.814 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.42 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.514 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.53 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.657 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.41 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.984 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 54.2 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.489 ' CB ' ' HD3' ' A' ' 67' ' ' ARG . 1.6 p30 -70.07 145.75 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.44 110.948 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -138.53 111.55 7.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 74.32 110.884 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -173.72 54.01 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 75.1 112.506 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' A' ' 120' ' ' ILE . 53.7 Cg_endo -69.83 -163.04 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.679 2.253 . . . . 74.35 112.329 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.55 -77.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 54.12 110.989 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.538 ' C ' ' SD ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -162.28 158.5 24.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.917 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.478 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -124.47 -174.25 2.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.03 111.069 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.7 p -155.6 -52.93 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 53.42 111.091 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.598 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.1 OUTLIER -92.73 78.99 4.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 73.31 110.833 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.416 ' OE1' ' CA ' ' A' ' 116' ' ' GLY . 24.6 mm-40 -141.77 155.2 45.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 55.33 110.867 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.535 ' HB3' HD11 ' A' ' 115' ' ' LEU . 47.4 tttm -65.6 -69.39 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 72.5 110.846 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -134.03 -89.05 0.38 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 63.32 110.862 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -119.22 -14.47 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 60.11 110.791 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -58.13 -11.78 2.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.0 110.907 -179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.416 ' CA ' ' OE1' ' A' ' 111' ' ' GLN . . . -78.19 64.45 3.45 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.769 -0.729 . . . . 74.42 112.457 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.526 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 22.1 t-20 -130.68 4.2 4.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.815 0.341 . . . . 74.32 110.9 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.776 ' HA ' HG13 ' A' ' 121' ' ' VAL . 4.5 ppt_? -76.67 34.64 0.14 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 64.2 110.85 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.552 HG11 ' CE1' ' A' ' 106' ' ' TYR . 96.6 t -79.51 -69.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.1 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.943 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -87.22 -33.11 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 73.22 111.155 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.943 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -62.55 -41.55 92.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 71.23 111.121 179.836 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.593 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.12 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.593 ' N ' HG23 ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.31 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.48 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.4 110.878 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.671 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.44 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.22 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.0 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.983 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.14 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 70.24 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.4 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 71.52 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.814 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 44.45 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.77 ' O ' HD23 ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 64.24 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.909 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.33 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 12' ' ' THR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.32 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.558 ' N ' HD23 ' A' ' 136' ' ' LEU . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.905 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.32 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.45 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.3 110.826 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 61.25 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.14 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.34 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.841 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.53 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.841 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 71.42 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 74.34 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.5 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.44 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.491 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.2 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.24 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 157' ' ' PHE . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.51 112.494 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.88 ' CE1' HD13 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.21 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.796 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 62.3 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 64.45 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.479 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.41 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.78 ' HB2' HD11 ' A' ' 41' ' ' LEU . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.22 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 63.42 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.5 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -49.04 147.22 5.01 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 72.34 110.9 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.443 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.83 -37.63 8.74 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.677 2.251 . . . . 71.01 112.349 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.5 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 2.6 mt -64.09 154.11 83.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.656 0.741 . . . . 73.1 110.891 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.79 -34.18 14.99 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 72.13 112.357 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.89 167.61 5.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 62.01 110.887 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.287 -1.125 . . . . 73.54 110.287 179.926 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.233 -1.147 . . . . 43.21 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' -2' ' ' GLY . 54.0 Cg_endo -69.77 -48.57 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.688 2.258 . . . . 70.03 112.358 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.429 HD22 ' H ' ' A' ' -3' ' ' LEU . 4.1 mm? -37.84 93.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 74.33 110.93 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 61.55 75.91 0.27 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.834 -0.698 . . . . 50.24 112.474 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.8 m -48.31 175.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 70.33 110.883 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -15.81 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 61.3 110.844 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.71 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -176.83 177.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.425 . . . . 70.24 111.089 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -116.53 -10.41 11.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 61.14 110.885 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.5 p -122.8 -19.83 6.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 73.52 110.893 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.71 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 29.1 mt-30 -80.34 4.32 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 72.42 110.894 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -106.62 86.84 2.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.622 0.725 . . . . 74.1 110.839 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 5' ' ' GLN . 54.3 Cg_endo -69.73 -16.08 37.5 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.7 2.267 . . . . 73.52 112.318 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.46 HD22 ' HD1' ' A' ' 151' ' ' TRP . 0.2 OUTLIER -112.55 21.97 15.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.271 -0.422 . . . . 51.44 110.93 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -69.54 -71.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 71.44 110.9 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.48 -23.1 66.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.459 . . . . 71.21 110.844 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.22 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.547 ' CG2' HD11 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 71.43 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.51 110.806 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 64.33 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.888 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.655 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.12 110.93 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 72.12 110.815 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.44 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' HG21 ' A' ' 46' ' ' THR . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.51 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.782 HG21 ' CB ' ' A' ' 125' ' ' CYS . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.41 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.595 ' CD2' ' HG2' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 64.32 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.35 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -70.9 -13.28 61.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.44 111.135 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' CB ' ' HB3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -33.39 111.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 73.35 110.908 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.61 ' HB2' HG22 ' A' ' 29' ' ' THR . 9.5 mt-10 -54.39 151.21 14.36 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 121.642 0.734 . . . . 72.41 110.902 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -10.06 27.6 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.647 2.231 . . . . 63.41 112.308 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -109.34 5.71 23.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 51.44 110.773 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.61 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.3 t -145.7 141.32 16.68 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.596 0.712 . . . . 75.34 111.087 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 137.38 35.19 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.68 2.253 . . . . 75.21 112.38 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.595 ' HG2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.4 152.81 95.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.619 0.724 . . . . 72.53 110.93 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.86 170.17 17.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.587 2.192 . . . . 63.3 112.356 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 170.61 16.1 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.711 2.274 . . . . 63.12 112.308 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -179.44 2.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.635 2.223 . . . . 73.23 112.368 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.471 HG21 ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -108.53 -51.19 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.2 111.196 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.733 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 58.2 m -151.63 -172.85 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.873 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.467 ' N ' ' HA3' ' A' ' 165' ' ' GLY . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.23 111.161 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 61.12 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.733 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.14 111.048 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.45 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.14 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 71.45 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.842 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 73.52 110.85 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.841 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 64.55 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.784 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 72.05 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 51.51 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.04 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.579 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.1 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.45 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 62.33 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.556 ' CD ' ' CE1' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.44 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.632 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 25.3 m80 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 71.42 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.44 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.11 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.03 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.41 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.34 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.34 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.4 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.31 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.51 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.13 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.31 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.662 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.11 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.716 ' HB2' HD13 ' A' ' 127' ' ' LEU . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.4 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.595 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.54 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.865 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.44 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 73.54 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 51.23 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.5 ' CB ' HD11 ' A' ' 93' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 50.24 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.14 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HG3' HD23 ' A' ' 78' ' ' LEU . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.937 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.937 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.13 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.43 110.86 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.22 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.53 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.55 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 72.24 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.421 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.12 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.965 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 53.03 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 62.43 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 73.01 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 92' ' ' MET . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.849 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 63.41 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.965 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 65.31 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.691 HG11 ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 74.31 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.426 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.14 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.67 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 65.42 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.3 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.784 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 62.31 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.938 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 72.52 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.114 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.33 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.528 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.45 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.01 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.938 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.12 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.458 ' HE1' ' HB2' ' A' ' 124' ' ' ASP . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.22 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -81.7 157.08 24.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.44 110.859 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.46 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 0.8 OUTLIER -124.28 150.11 45.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 71.04 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.514 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -164.67 48.18 0.29 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.771 -0.728 . . . . 43.11 112.503 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.3 Cg_endo -69.87 -163.22 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.716 2.277 . . . . 75.22 112.335 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.476 ' O ' ' N ' ' A' ' 108' ' ' ALA . 8.4 t80 -124.37 -17.69 6.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 75.02 110.93 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.508 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 15.4 mmt -37.12 93.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 70.03 110.884 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.531 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . . . -96.72 -150.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 71.35 111.18 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.835 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.73 -84.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.311 -0.404 . . . . 74.32 111.081 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.835 ' N ' HG22 ' A' ' 109' ' ' VAL . 5.1 mtmt -75.91 96.17 3.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.895 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.531 ' NE2' ' HB3' ' A' ' 108' ' ' ALA . 18.3 mm-40 -141.83 -168.9 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 72.12 110.875 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 112' ' ' LYS . 3.5 ptpp? -150.31 117.06 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.34 110.878 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.37 99.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 74.11 110.864 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -134.97 -67.02 0.56 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.182 -0.463 . . . . 73.31 110.868 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.818 HD13 ' N ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.5 -67.19 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.426 . . . . 70.31 110.951 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 127.86 -40.66 1.7 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.737 -0.744 . . . . 74.32 112.5 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.522 ' OD1' HG11 ' A' ' 121' ' ' VAL . 20.8 p30 -177.94 -170.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.355 . . . . 73.33 110.868 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.649 ' O ' HG12 ' A' ' 121' ' ' VAL . 7.4 mmt180 -94.88 173.36 7.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 65.43 110.895 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.722 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.23 -12.66 14.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.45 111.111 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.877 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -53.89 -32.03 21.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 41.34 111.105 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.877 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -68.25 -49.27 68.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 74.33 111.176 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.722 ' CG2' HG12 ' A' ' 119' ' ' VAL . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 71.11 111.144 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.31 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 127' ' ' LEU . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.44 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.782 ' CB ' HG21 ' A' ' 20' ' ' ILE . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.34 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.964 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 64.12 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.964 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 64.41 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 125' ' ' CYS . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.32 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.15 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 64.32 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.114 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 61.55 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.24 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 65.41 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 73.33 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.13 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.05 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.436 ' CZ ' ' HA3' ' A' ' -5' ' ' GLY . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.05 110.922 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.502 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.34 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.66 ' NE2' HD11 ' A' ' 90' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.22 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 61.31 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.51 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.838 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 73.51 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.756 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.24 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.53 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.34 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 71.44 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 45.01 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.46 ' HD1' HD22 ' A' ' 8' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.32 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.43 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.54 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 72.21 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 61.44 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.495 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.1 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.527 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.45 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.841 ' CD2' HG11 ' A' ' 45' ' ' VAL . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 53.0 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 -54.91 142.15 56.36 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.13 110.899 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.466 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.3 Cg_endo -69.79 -43.85 2.39 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 73.33 112.331 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 162' ' ' LEU . 4.0 mm? -94.39 144.02 27.29 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.564 0.697 . . . . 74.22 110.899 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -50.26 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.697 2.265 . . . . 62.45 112.335 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.51 HD23 ' C ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -83.43 -172.58 4.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 61.52 110.953 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.467 ' HA3' ' N ' ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.239 -1.144 . . . . 65.33 110.239 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.266 -1.134 . . . . 71.41 110.266 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.73 -17.53 37.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.643 2.229 . . . . 75.3 112.404 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.533 ' N ' ' CD2' ' A' ' -3' ' ' LEU . 0.0 OUTLIER -58.36 78.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 70.14 110.908 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . -114.11 -1.2 23.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.764 -0.731 . . . . 71.01 112.493 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.74 77.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.879 0.371 . . . . 64.0 110.851 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.472 ' N ' ' O ' ' A' ' -2' ' ' GLY . 19.9 ptp -91.06 -54.01 4.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 35.23 110.915 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 5' ' ' GLN . . . -68.27 176.7 2.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 71.44 111.046 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -100.81 -77.87 0.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 72.3 110.871 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -61.31 -21.77 64.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 72.34 110.897 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.451 ' HB2' ' CB ' ' A' ' 2' ' ' ALA . 10.1 mm-40 -88.11 60.18 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 71.31 110.919 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -53.03 144.3 28.17 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.656 0.741 . . . . 61.34 110.876 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 2.82 3.22 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.717 2.278 . . . . 51.53 112.296 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.657 HD13 HH21 ' A' ' 142' ' ' ARG . 0.4 OUTLIER -65.03 -25.82 68.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 61.4 110.921 179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 2.2 p-80 -71.31 -47.48 56.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.21 110.846 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -75.66 -21.82 57.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.888 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.405 HH21 ' CZ ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.32 110.928 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.473 HG22 ' HD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.403 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.11 110.92 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 70.21 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 45.31 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 61.14 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.515 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.12 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.601 ' CE2' HG21 ' A' ' 46' ' ' THR . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.33 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.917 HG22 ' SD ' ' A' ' 101' ' ' MET . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 53.33 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.55 ' CG ' ' ND2' ' A' ' 117' ' ' ASN . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.22 110.87 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.647 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 73.32 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 43.03 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.61 ' HB1' ' OE1' ' A' ' 103' ' ' GLN . . . -84.27 16.91 2.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 34.11 111.082 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.408 ' HD2' ' C ' ' A' ' 24' ' ' ALA . 2.3 mmm180 -111.56 112.65 24.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 74.32 110.875 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -38.7 158.33 0.1 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.603 0.716 . . . . 62.32 110.92 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -8.61 24.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.633 2.222 . . . . 74.33 112.343 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -95.64 6.01 50.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 54.2 110.846 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -144.55 137.91 14.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.543 0.687 . . . . 71.41 111.179 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 146.79 61.24 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.641 2.228 . . . . 74.44 112.323 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -95.28 168.35 11.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 71.23 110.921 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 31' ' ' GLU . 52.6 Cg_endo -69.78 167.16 25.26 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.674 2.25 . . . . 74.41 112.38 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 170.16 17.18 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.711 2.274 . . . . 74.15 112.357 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 174.73 8.99 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.687 2.258 . . . . 72.42 112.417 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.442 ' CG2' ' CZ ' ' A' ' 14' ' ' ARG . 1.4 m -106.86 -54.23 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.272 -0.422 . . . . 74.11 111.132 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 55.3 m -143.31 -173.86 4.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 61.51 110.773 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 37' ' ' VAL . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 64.52 111.045 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.929 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.22 110.848 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.528 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.24 111.171 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.445 ' CB ' HD21 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 53.31 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.13 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.688 ' CD1' HG12 ' A' ' 91' ' ' VAL . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.3 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.845 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.44 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.669 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 70.4 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.597 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.4 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.597 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 62.14 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 65.13 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.33 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.42 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.617 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 51.1 m80 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 64.31 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 52.51 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.22 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.21 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.617 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.41 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 30.44 110.808 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.43 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.23 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 55.01 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.24 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.418 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.21 110.861 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.54 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.43 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.885 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.13 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.811 ' O ' HD13 ' A' ' 100' ' ' LEU . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 73.2 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.31 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 70.43 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.885 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 72.0 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 1.026 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.04 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 72.12 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.12 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.711 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.22 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 1.102 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 41.51 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.45 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.903 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 65.32 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 62.32 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 64.12 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 72.52 110.898 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 65.22 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.508 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.32 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 63.44 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.797 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 70.22 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 70.23 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.731 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.33 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.41 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 71.21 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.797 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 53.03 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.712 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 62.41 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.535 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.54 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.819 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 71.24 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.577 HD11 HD11 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.33 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.43 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 1.032 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.01 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.809 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.42 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.45 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.586 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.33 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.032 HD11 ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 54.33 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.917 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.45 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.462 ' HB3' ' NE ' ' A' ' 67' ' ' ARG . 6.6 p30 -88.74 157.44 18.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.22 110.876 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.61 ' OE1' ' HB1' ' A' ' 24' ' ' ALA . 3.3 mm100 -140.14 150.57 44.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 74.2 110.98 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.412 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -178.42 54.56 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.73 -0.748 . . . . 63.22 112.434 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.491 ' HB3' ' NE ' ' A' ' 118' ' ' ARG . 54.0 Cg_endo -69.8 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.71 2.273 . . . . 75.21 112.334 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.74 -70.35 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 71.33 110.988 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.636 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.14 74.32 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 72.43 110.897 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.2 49.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.14 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.632 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.3 p -114.43 -50.56 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 71.25 111.158 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.632 ' N ' HG13 ' A' ' 109' ' ' VAL . 19.8 ttpt -92.62 77.99 4.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.445 . . . . 74.25 110.917 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.568 ' OE1' HD11 ' A' ' 115' ' ' LEU . 41.0 mm-40 -134.84 118.32 16.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.842 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.458 ' O ' ' C ' ' A' ' 113' ' ' ARG . 12.7 mttm -75.84 49.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 73.55 110.902 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.458 ' C ' ' O ' ' A' ' 112' ' ' LYS . 20.9 ptt85 33.99 48.64 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 64.12 110.83 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.81 -51.82 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 63.54 110.885 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.77 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.3 OUTLIER -102.08 -17.05 16.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 73.32 110.888 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.77 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 35.03 -92.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 44.51 112.538 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.987 ' OD1' HG21 ' A' ' 121' ' ' VAL . 6.8 m-80 -58.58 125.45 23.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.743 0.306 . . . . 71.35 110.962 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.549 ' HB3' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -53.85 -168.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 71.4 110.909 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.642 HG23 ' N ' ' A' ' 120' ' ' ILE . 26.9 m -79.12 -53.95 12.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 72.13 111.098 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.642 ' N ' HG23 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -50.12 -38.31 14.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 41.33 111.089 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.987 HG21 ' OD1' ' A' ' 117' ' ' ASN . 2.5 p -64.12 -47.04 91.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 54.4 111.134 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.474 ' CG2' ' O ' ' A' ' 119' ' ' VAL . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.41 111.113 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.41 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 63.11 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.673 ' O ' HG23 ' A' ' 129' ' ' VAL . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.23 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 54.34 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 73.3 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 1.026 ' CG1' HG21 ' A' ' 71' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.53 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.779 HG13 ' HB3' ' A' ' 16' ' ' LEU . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.44 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 44.15 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 54.15 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.809 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.32 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD1' ' HG3' ' A' ' 137' ' ' MET . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 63.25 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 1.102 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.14 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.521 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.23 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.569 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 42.31 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.14 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.54 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.657 HH21 HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 65.44 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 147' ' ' ALA . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.43 111.142 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 71.51 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.827 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 72.05 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.742 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 73.52 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 143' ' ' ALA . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.11 111.103 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.731 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.41 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 43.51 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.24 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.34 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.3 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 64.14 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.712 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.12 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.767 ' HA ' HD23 ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 70.23 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.12 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.464 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.32 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.845 ' CD2' HG11 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.35 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.456 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.34 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.885 HD22 HD12 ' A' ' 162' ' ' LEU . 2.0 t30 -48.29 145.89 5.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.1 110.913 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.49 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.4 Cg_endo -69.74 -38.05 8.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.7 2.267 . . . . 74.0 112.352 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 1.088 HD13 ' O ' ' A' ' 162' ' ' LEU . 0.0 OUTLIER -58.21 158.02 15.21 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.62 0.724 . . . . 61.21 110.922 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.684 ' N ' HD22 ' A' ' 162' ' ' LEU . 53.7 Cg_endo -69.86 -88.94 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.635 2.224 . . . . 65.22 112.354 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.815 ' O ' HD21 ' A' ' 162' ' ' LEU . 0.3 OUTLIER -31.18 145.82 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.278 -0.419 . . . . 75.35 110.884 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.509 0 N-CA-C 110.266 -1.133 . . . . 74.14 110.266 179.928 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.521 ' N ' ' CD ' ' A' ' -4' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.278 -1.129 . . . . 73.03 110.278 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' -5' ' ' GLY . 53.1 Cg_endo -69.84 -10.61 28.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.68 2.253 . . . . 73.3 112.296 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.1 OUTLIER -34.32 -66.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 74.33 110.895 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 90.89 -174.44 39.13 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.716 -0.754 . . . . 43.53 112.513 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 p -124.88 162.24 24.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 74.02 110.851 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tpp -72.62 -53.84 10.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.52 110.907 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.96 166.68 19.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 42.24 111.141 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.53 -37.52 0.84 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 74.23 110.831 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -63.85 -21.55 66.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 71.21 110.903 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.414 ' N ' ' OE1' ' A' ' 5' ' ' GLN . 15.4 mp0 -113.57 18.27 17.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 64.41 110.869 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.97 164.29 15.85 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.598 0.713 . . . . 73.31 110.838 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.739 2.292 . . . . 71.23 112.387 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.578 HD12 HH21 ' A' ' 142' ' ' ARG . 8.7 mt -64.78 -5.8 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.892 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -49.17 -76.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 73.15 110.871 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -66.71 -25.06 66.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.51 110.927 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.51 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.611 HG21 HD11 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.53 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.486 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.13 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.43 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.699 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 72.02 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.522 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 65.13 110.819 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.01 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 63.34 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.631 HG22 ' HE3' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.12 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.23 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CZ ' ' HG2' ' A' ' 32' ' ' PRO . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.03 110.92 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.35 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.6 17.26 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 73.32 111.12 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -64.33 111.91 2.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 72.41 110.878 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.39 151.28 60.38 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.579 0.704 . . . . 54.45 110.892 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -6.6 19.01 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.734 2.289 . . . . 70.24 112.334 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -99.93 5.72 45.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.199 -0.455 . . . . 73.21 110.841 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' HG23 ' A' ' 29' ' ' THR . 1.5 t -159.29 126.16 2.57 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.543 0.687 . . . . 74.21 111.14 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 143.49 50.76 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.694 2.263 . . . . 71.53 112.321 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -80.44 148.83 67.38 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.551 0.691 . . . . 63.33 110.957 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CZ ' ' A' ' 22' ' ' PHE . 53.8 Cg_endo -69.75 171.3 14.71 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 65.22 112.368 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 170.33 16.77 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.731 2.287 . . . . 42.31 112.3 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CG ' HD21 ' A' ' 162' ' ' LEU . 54.4 Cg_endo -69.71 158.62 56.39 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.681 2.254 . . . . 75.45 112.384 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.64 -50.96 4.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.27 -0.423 . . . . 62.41 111.15 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.418 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 67.0 m -122.7 164.11 18.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 72.51 110.883 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.33 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 55.32 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 70.25 111.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.24 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.44 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 72.23 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.488 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.13 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 73.04 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.586 HG23 ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.22 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.772 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.52 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.04 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.45 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.3 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 54.4 m80 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.31 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.24 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.32 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 64.13 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 70.03 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.52 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 71.42 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 41.1 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.33 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.24 110.875 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.14 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.01 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 64.32 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.541 HD21 ' HE1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.33 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.82 HG22 HD21 ' A' ' 132' ' ' LEU . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 70.43 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HE2' ' CE1' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 70.41 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.532 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.32 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.745 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.877 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.22 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 61.44 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.932 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 62.01 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.932 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.51 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.55 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.22 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.05 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.15 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.837 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.04 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.23 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.694 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 64.33 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.24 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.52 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.14 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 60.44 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 63.45 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.448 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.31 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 1.09 HD11 HD22 ' A' ' 132' ' ' LEU . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 70.41 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.792 HD13 HD13 ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.02 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.772 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.52 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 1.002 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.33 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 1.064 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 43.14 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 12.23 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.002 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.41 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.631 ' HE3' HG22 ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.24 152.37 42.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 65.24 110.863 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -150.52 131.68 14.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 61.44 110.954 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.558 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -154.5 46.02 0.55 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.738 -0.744 . . . . 53.41 112.527 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.558 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.6 Cg_endo -69.8 -163.47 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.708 2.272 . . . . 71.43 112.35 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.489 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.6 p90 -124.42 -67.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.881 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.712 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.09 73.37 1.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.487 . . . . 65.03 110.885 179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.06 58.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 72.42 111.075 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.633 HG13 ' N ' ' A' ' 110' ' ' LYS . 9.4 p -122.73 -51.04 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 55.4 111.058 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.633 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.3 mtmt -98.16 77.32 2.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.896 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.447 ' O ' ' N ' ' A' ' 113' ' ' ARG . 19.6 mm-40 -133.99 17.44 3.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 52.44 110.876 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 111' ' ' GLN . 9.7 tppt? 35.16 34.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.22 110.879 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 111' ' ' GLN . 0.5 OUTLIER 35.56 42.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 74.34 110.86 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' CG ' ' N ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -92.71 -54.38 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 52.24 110.899 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.572 HD23 ' H ' ' A' ' 115' ' ' LEU . 1.7 pt? -101.88 -16.91 16.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 75.44 110.89 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 48.82 48.65 29.82 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 70.34 112.463 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 1.4 p30 40.18 47.33 2.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.808 0.337 . . . . 64.51 110.875 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.799 ' HA ' HG13 ' A' ' 121' ' ' VAL . 10.0 ptp180 -81.72 34.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 74.42 110.828 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.819 HG13 ' H ' ' A' ' 120' ' ' ILE . 1.2 p -77.67 -68.84 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 73.42 111.102 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.819 ' H ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -86.53 -36.07 9.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 72.02 111.113 179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.799 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.99 -41.92 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 71.1 111.126 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.545 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 62.12 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.545 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.15 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 128' ' ' ILE . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 72.52 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.2 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 63.21 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.787 ' CG1' HG21 ' A' ' 71' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.22 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.699 HG13 ' HB3' ' A' ' 16' ' ' LEU . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.15 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.429 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.3 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.609 ' CE1' ' HE2' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 1.09 HD22 HD11 ' A' ' 93' ' ' LEU . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.41 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.32 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 54.42 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.877 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.611 HD11 HG21 ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 71.11 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.513 ' HE3' ' CD1' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 62.43 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.15 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 71.43 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.497 ' C ' ' CD ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.24 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.578 HH21 HD12 ' A' ' 8' ' ' LEU . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.54 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 35.45 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' HD2' HD23 ' A' ' 148' ' ' LEU . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.51 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.32 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.701 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.45 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.469 ' HB3' ' HD3' ' A' ' 144' ' ' ARG . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.02 111.135 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 63.14 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.53 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 73.31 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 71.53 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.23 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.715 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.53 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.21 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.578 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 64.41 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.428 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 63.43 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.42 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.42 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.512 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.5 148.68 3.3 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.01 110.874 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.464 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.6 Cg_endo -69.78 -38.63 7.49 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.698 2.265 . . . . 72.11 112.391 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.512 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 3.2 mp -58.81 143.88 82.07 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 54.23 110.892 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -50.93 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.736 2.29 . . . . 73.54 112.383 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.5 mp -82.15 156.71 24.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 32.43 110.903 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.296 -1.122 . . . . 60.43 110.296 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.308 -1.117 . . . . 74.13 110.308 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -4.91 14.98 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.682 2.255 . . . . 72.12 112.293 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.882 ' O ' HD23 ' A' ' -3' ' ' LEU . 0.1 OUTLIER -48.84 171.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.34 110.871 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 139.17 165.31 10.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.695 -0.764 . . . . 70.35 112.51 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.1 m -159.79 137.94 10.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 64.33 110.832 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.403 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 19.1 ptm -81.14 -52.91 6.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 63.32 110.879 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.403 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -135.23 169.88 16.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 73.54 111.114 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -138.23 4.7 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 70.13 110.883 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.5 m -130.54 7.47 4.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 71.53 110.89 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -100.3 -15.49 18.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 75.53 110.889 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HB2' ' NH2' ' A' ' 11' ' ' ARG . 2.1 m-20 -113.11 163.74 17.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.711 . . . . 73.13 110.889 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.491 ' HG2' ' CD2' ' A' ' 9' ' ' HIS . 54.1 Cg_endo -69.66 -163.68 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.707 2.271 . . . . 63.41 112.351 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tp -99.37 -9.48 23.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 72.22 110.927 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.667 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -69.88 -55.52 9.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 73.33 110.87 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.667 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.6 pt-20 -74.72 -15.62 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.44 . . . . 75.3 110.804 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.21 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.823 HG21 HD11 ' A' ' 136' ' ' LEU . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 63.11 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.11 110.874 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 71.51 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.788 HD11 ' CD1' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.32 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.828 ' HB3' HG13 ' A' ' 129' ' ' VAL . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 74.51 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.474 ' HA ' HG13 ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.44 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.775 ' CE1' HD13 ' A' ' 20' ' ' ILE . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 64.34 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.839 HG22 ' SD ' ' A' ' 101' ' ' MET . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.43 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.2 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.496 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.13 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.23 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.632 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . -80.86 15.88 1.64 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 25.44 111.131 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.11 112.56 24.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.11 110.941 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -44.18 156.5 0.32 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.689 0.756 . . . . 71.04 110.834 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -10.35 28.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.713 2.275 . . . . 72.31 112.352 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -91.37 5.74 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 73.24 110.923 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 t -139.56 140.78 26.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.556 0.693 . . . . 33.21 111.125 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.78 136.68 33.57 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.74 2.293 . . . . 73.41 112.391 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.466 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -84.05 157.94 62.21 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.651 0.739 . . . . 71.23 110.852 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 169.19 19.5 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.728 2.285 . . . . 65.13 112.31 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.406 ' HG2' HD11 ' A' ' -3' ' ' LEU . 53.1 Cg_endo -69.74 170.15 17.24 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.714 2.276 . . . . 71.41 112.303 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 171.36 14.67 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.662 2.242 . . . . 64.51 112.334 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.443 ' CG2' ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -106.03 -48.38 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 54.21 111.11 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.591 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -142.0 -175.32 4.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.33 110.822 -179.805 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.11 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.34 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.591 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.14 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.21 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.981 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.01 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.085 HD23 HG12 ' A' ' 91' ' ' VAL . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 62.22 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.12 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.55 110.803 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.651 HG23 ' N ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 60.13 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.651 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.32 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.514 HD13 ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.41 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 70.11 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.44 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.645 ' OE1' ' CE1' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.52 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.645 ' CE1' ' OE1' ' A' ' 52' ' ' GLU . 38.2 m80 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.34 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 74.32 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 62.2 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.12 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.33 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.11 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 35.41 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 60.15 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 65.3 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 50.03 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.22 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.787 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.35 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.2 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.12 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.451 ' N ' HD23 ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 61.43 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.915 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.41 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.42 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 72.21 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.726 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.02 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.866 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 71.03 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.14 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.85 ' HG3' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 72.14 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.919 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 62.12 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 60.14 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.421 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.911 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.41 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.33 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.501 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 72.11 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.446 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.03 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.788 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.24 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.34 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.725 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.41 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.1 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.513 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 44.21 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.788 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 1.085 HG12 HD23 ' A' ' 42' ' ' LEU . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.23 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.02 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 42' ' ' LEU . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.05 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.958 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 53.15 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.859 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 61.14 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.818 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.11 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.958 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 72.54 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.839 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.14 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.33 134.84 35.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.12 110.854 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -119.36 116.53 26.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 73.13 110.894 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.532 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -163.14 47.48 0.32 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.748 -0.739 . . . . 74.04 112.496 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.81 -162.85 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.631 2.22 . . . . 72.04 112.389 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.537 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.5 t80 -124.04 -13.35 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.01 110.947 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.631 ' SD ' HD12 ' A' ' 115' ' ' LEU . 22.5 mmt -36.84 95.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 72.23 110.876 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.481 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -92.76 -149.57 0.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.31 111.043 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.817 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.56 -84.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 72.42 111.098 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.817 ' N ' HG22 ' A' ' 109' ' ' VAL . 20.2 ttpt -66.66 87.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.429 . . . . 74.53 110.949 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 13.4 mm-40 -142.44 150.46 40.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 74.43 110.874 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 167.96 1.4 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 62.12 110.88 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 23.5 tpt85 -107.82 -11.81 15.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 74.34 110.855 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.416 ' OD1' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -87.18 0.95 54.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.859 -179.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.631 HD12 ' SD ' ' A' ' 107' ' ' MET . 0.5 OUTLIER -76.39 -63.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 64.24 110.895 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 118' ' ' ARG . . . 76.8 27.17 61.18 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 73.42 112.496 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.8 p-10 40.33 27.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.826 0.346 . . . . 72.1 110.894 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' A' ' 121' ' ' VAL . 5.8 ptt180 -80.8 32.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 62.35 110.827 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.621 HG22 ' N ' ' A' ' 120' ' ' ILE . 0.1 OUTLIER -78.95 -66.45 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.54 111.122 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.768 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -85.56 -40.04 14.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 72.24 111.054 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.768 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.1 OUTLIER -56.31 -46.52 81.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 75.23 111.167 179.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.573 ' N ' HG23 ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.11 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.31 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.815 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 71.05 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.13 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.24 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.915 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 54.44 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.828 HG13 ' HB3' ' A' ' 16' ' ' LEU . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 53.13 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.458 ' CG ' ' O ' ' A' ' 126' ' ' CYS . 3.2 m-20 -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.917 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.13 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.859 HD21 ' HB2' ' A' ' 97' ' ' ALA . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.44 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.635 ' O ' HD13 ' A' ' 136' ' ' LEU . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.45 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.11 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.866 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.24 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.972 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.885 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.45 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.52 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.44 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.41 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 18.8 m80 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.14 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.24 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.55 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.24 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.843 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 71.43 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.726 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.22 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 71.53 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.725 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.22 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 40.44 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.12 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.21 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.43 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.11 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.61 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 61.12 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.829 ' HA ' HD23 ' A' ' 41' ' ' LEU . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 62.51 110.887 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.57 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.33 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 64.04 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.467 ' CB ' HD11 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.03 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 65.32 110.917 179.914 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.981 ' HA ' HD22 ' A' ' 41' ' ' LEU . 4.5 t30 -48.58 140.17 10.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 60.21 110.878 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.3 Cg_endo -69.74 -37.24 9.49 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.731 2.288 . . . . 43.0 112.361 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.445 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 3.9 mp -94.02 162.0 28.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.558 0.694 . . . . 60.31 110.954 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -90.41 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.629 2.22 . . . . 75.03 112.408 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 165' ' ' GLY . 4.7 mp -115.4 179.28 4.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.902 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.51 0 N-CA-C 110.28 -1.128 . . . . 45.21 110.28 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.443 ' N ' ' OD2' ' A' ' 152' ' ' ASP . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.282 -1.127 . . . . 24.41 110.282 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 1.11 4.73 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.627 2.218 . . . . 53.34 112.404 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.434 ' C ' ' CD2' ' A' ' -3' ' ' LEU . 0.5 OUTLIER -67.61 85.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 71.43 110.857 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 114.73 115.58 3.09 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.66 -0.781 . . . . 61.3 112.49 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.3 t -122.4 75.55 1.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.888 0.375 . . . . 45.23 110.824 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HG2' ' N ' ' A' ' 2' ' ' ALA . 1.1 pmm? -56.18 -33.99 65.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 61.42 110.899 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -166.51 176.97 6.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 64.42 111.094 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -111.93 -18.96 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 65.14 110.927 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.6 t -127.45 5.27 6.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 75.4 110.848 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.747 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 49.1 mm-40 -99.73 9.74 42.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 73.24 110.925 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.46 144.24 29.1 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.58 0.705 . . . . 74.11 110.89 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.728 2.285 . . . . 73.33 112.392 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.05 -18.99 65.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.45 . . . . 74.12 110.949 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.641 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 3.3 p80 -66.09 -54.63 23.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.485 . . . . 63.35 110.837 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.641 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 25.9 tt0 -66.36 -21.05 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.109 -0.496 . . . . 71.14 110.84 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.33 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.53 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.592 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 71.44 110.951 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.23 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.73 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.24 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.863 HD11 HD11 ' A' ' 94' ' ' LEU . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 54.23 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.546 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 64.32 110.896 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.803 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.3 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.42 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.644 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 70.22 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.11 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.694 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . -87.75 17.28 4.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 51.44 111.103 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 87.2 mtt-85 -108.21 112.78 25.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 75.03 110.876 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 13.3 mt-10 -33.5 147.28 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 121.697 0.76 . . . . 64.13 110.875 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -16.73 37.63 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.741 2.294 . . . . 70.43 112.307 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -78.95 5.68 11.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 74.21 110.856 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.31 141.02 17.41 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.612 0.72 . . . . 74.33 111.144 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 136.62 33.4 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.671 2.247 . . . . 63.01 112.36 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.572 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -84.92 158.35 59.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 75.32 110.872 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.6 Cg_endo -69.8 170.12 17.36 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.645 2.23 . . . . 70.52 112.419 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.7 170.41 16.56 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.738 2.292 . . . . 71.4 112.333 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.702 2.268 . . . . 61.34 112.383 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.546 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -123.13 -39.93 2.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 64.2 111.21 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.512 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 19.1 m -137.81 177.38 7.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 43.12 110.816 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 64.34 111.06 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.73 ' CG ' HD22 ' A' ' 15' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 64.44 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.512 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.12 111.102 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 55.43 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.35 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 63.33 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 65.13 110.819 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.4 110.844 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.678 HG23 ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 54.31 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.44 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 73.44 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.543 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.54 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.15 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.11 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 56.5 m80 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.21 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.6 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.2 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 61.21 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.22 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 54.22 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 50.34 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.42 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 1.072 ' CD1' HD21 ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 70.15 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 61.2 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.23 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.15 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.21 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.693 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.02 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.33 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.44 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 1.072 HD21 ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 54.42 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.985 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 60.42 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.615 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.45 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.3 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 64.13 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.22 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.906 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.02 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.91 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.21 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.91 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.2 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.4 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.3 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.759 ' N ' HE21 ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 55.14 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 71.52 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.799 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.02 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 70.02 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 1.087 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.42 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.4 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.43 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.087 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.24 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 72.11 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.56 ' HG2' HG21 ' A' ' 49' ' ' ILE . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.25 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.56 ' CD2' HD11 ' A' ' 78' ' ' LEU . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 63.43 110.94 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 73.2 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.565 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.11 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.996 ' CE2' HD11 ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.13 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 63.05 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.33 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.671 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 51.43 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.996 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.44 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.803 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 70.3 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.416 ' O ' ' CD ' ' A' ' 103' ' ' GLN . 0.1 OUTLIER -88.98 136.82 32.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.961 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 103' ' ' GLN . 5.9 mm100 -142.68 126.99 17.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.431 . . . . 74.35 110.918 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.69 46.63 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.696 -0.764 . . . . 64.44 112.428 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.2 Cg_endo -69.83 -161.68 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.629 2.219 . . . . 63.41 112.383 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.624 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -93.29 4.02 54.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 60.33 110.941 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.608 ' N ' ' SD ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.89 91.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 62.02 110.831 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.85 -154.34 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 72.34 111.166 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.856 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -67.68 -85.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.428 . . . . 61.33 111.118 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.856 ' N ' HG22 ' A' ' 109' ' ' VAL . 12.7 mtmt -68.83 94.28 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.162 -0.472 . . . . 75.15 110.914 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -138.86 -172.11 3.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 54.34 110.979 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.7 175.23 10.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 63.23 110.879 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 55.31 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.277 -0.419 . . . . 70.43 110.904 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -97.03 -55.0 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 75.21 110.846 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -77.87 -16.11 58.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 72.44 110.891 -179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.564 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 45.26 92.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 62.14 112.528 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.447 ' C ' ' O ' ' A' ' 116' ' ' GLY . 12.1 t-20 -34.69 112.35 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.21 110.851 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.778 ' HA ' HG13 ' A' ' 121' ' ' VAL . 40.4 mtm180 -155.2 16.65 0.41 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 44.53 110.816 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.6 t -77.05 -69.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 61.41 111.165 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.718 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.35 -32.42 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 75.43 111.143 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.778 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -62.07 -43.33 97.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 71.22 111.152 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.22 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 61.22 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.52 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 1.012 ' O ' HG12 ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.41 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 63.01 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 123' ' ' ARG . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 73.44 110.885 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.985 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.2 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 1.012 HG12 ' O ' ' A' ' 125' ' ' CYS . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.12 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 72.11 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.21 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.606 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 62.13 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 65.41 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.624 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.45 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 55.03 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.606 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 64.41 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 53.42 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.33 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.12 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 8.6 m80 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.14 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 62.2 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.24 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.33 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.22 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.691 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.42 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.02 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 72.21 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 70.32 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 72.14 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 62.42 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 72.55 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.718 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 65.43 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.688 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.34 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.35 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.642 ' CD2' HG11 ' A' ' 45' ' ' VAL . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.45 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 55.31 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.68 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.96 168.03 0.19 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.53 110.846 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.459 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.75 -44.21 2.22 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.659 2.239 . . . . 72.21 112.318 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.429 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 3.9 mm? -109.44 110.08 60.03 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.656 0.741 . . . . 63.42 110.878 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 61.34 112.364 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.2 mp -101.44 165.51 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.258 -0.428 . . . . 75.0 110.884 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.259 -1.136 . . . . 73.11 110.259 179.876 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.326 -1.11 . . . . 71.3 110.326 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.8 -90.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.614 2.209 . . . . 75.35 112.311 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.615 ' O ' HD13 ' A' ' -3' ' ' LEU . 0.7 OUTLIER 48.26 36.4 6.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 70.42 110.906 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -143.5 161.1 27.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.767 -0.73 . . . . 54.21 112.497 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.1 t -108.88 74.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.845 0.355 . . . . 75.31 110.83 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ptp -91.01 -38.68 12.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 72.34 110.856 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.95 150.97 36.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.225 -0.443 . . . . 63.11 111.092 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.09 4.14 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 71.22 110.848 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.512 ' CB ' ' CE1' ' A' ' 9' ' ' HIS . 47.1 t -111.53 51.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.23 110.866 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -52.01 -40.54 61.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.43 110.959 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -110.33 143.14 27.47 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.55 0.691 . . . . 73.3 110.833 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.67 -9.08 25.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.667 2.245 . . . . 20.13 112.36 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.792 HD23 ' HE1' ' A' ' 137' ' ' MET . 0.7 OUTLIER -113.0 11.86 19.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.192 -0.458 . . . . 71.04 110.975 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.656 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 5.7 p-80 -69.6 -54.44 14.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 72.13 110.813 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.656 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 3.1 pt-20 -82.25 -12.35 58.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.438 . . . . 73.35 110.939 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.696 ' NE ' HD12 ' A' ' 8' ' ' LEU . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.54 110.873 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.954 ' CG2' HD21 ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 72.3 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.31 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 64.53 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 70.24 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.521 ' HA ' HG21 ' A' ' 129' ' ' VAL . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 64.33 110.845 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.45 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.732 ' CE1' HG21 ' A' ' 46' ' ' THR . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.53 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.66 HG21 ' CB ' ' A' ' 125' ' ' CYS . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 64.44 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.22 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.623 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.44 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.429 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 64.24 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.08 17.22 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.55 111.075 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -110.58 112.61 24.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.213 -0.449 . . . . 64.11 110.856 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -38.23 155.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.689 0.757 . . . . 73.13 110.798 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -12.99 34.17 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.687 2.258 . . . . 74.04 112.311 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -87.66 5.68 38.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.287 -0.415 . . . . 72.43 110.877 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.24 141.14 18.69 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.674 0.749 . . . . 72.24 111.109 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 136.91 34.13 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.632 2.222 . . . . 53.4 112.325 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.579 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -79.89 156.83 74.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.668 0.747 . . . . 73.42 110.861 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 169.63 18.49 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.646 2.231 . . . . 74.35 112.334 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 159.07 54.76 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.703 2.269 . . . . 74.33 112.339 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 170.16 17.21 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.691 2.26 . . . . 72.02 112.377 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.436 HG21 ' HE ' ' A' ' 14' ' ' ARG . 1.5 m -97.25 -58.01 2.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 61.3 111.089 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.464 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -133.6 -177.41 4.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 61.15 110.82 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.632 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 73.03 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.776 ' HB2' HD22 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.3 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.14 111.068 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 63.41 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.835 HD21 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 53.31 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 62.14 110.947 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.54 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.8 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.44 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.732 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.43 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 71.33 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.642 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 71.13 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.642 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.11 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.02 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.12 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 51.2 m80 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.14 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 60.44 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.24 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 62.14 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.04 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 73.22 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.442 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 70.15 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.45 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.826 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.13 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.856 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.51 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.986 HD12 HD13 ' A' ' 127' ' ' LEU . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.45 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.826 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 61.31 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.964 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 64.15 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.52 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.12 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.772 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 62.43 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.53 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.86 ' HG3' HD23 ' A' ' 78' ' ' LEU . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.45 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 65.31 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 73.43 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.02 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.48 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 72.24 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.3 110.874 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.495 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.52 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.819 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 65.35 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.41 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.711 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.31 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.499 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.33 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.819 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 65.35 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.51 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 64.22 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.837 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.24 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.835 HD23 HD21 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 42.14 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.697 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.22 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.944 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 70.31 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 54.3 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.13 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.34 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.944 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.14 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.566 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 73.23 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.1 OUTLIER -83.73 161.38 21.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.42 110.926 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -149.76 117.61 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 63.31 110.897 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.426 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.69 53.29 0.47 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.76 -0.734 . . . . 54.52 112.524 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.515 ' HB2' ' CD1' ' A' ' 106' ' ' TYR . 54.1 Cg_endo -69.73 -163.32 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.703 2.269 . . . . 74.11 112.341 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.73 -83.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.94 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.671 ' H ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -152.05 -156.56 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.11 110.93 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -142.35 104.59 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 71.31 111.073 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.643 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.0 p -155.24 -52.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 75.22 111.119 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.643 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.15 77.6 1.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 71.42 110.896 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -127.97 -60.43 1.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 74.21 110.88 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.41 ' NZ ' ' HB3' ' A' ' 112' ' ' LYS . 0.3 OUTLIER 38.11 51.03 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 65.13 110.927 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 72.9 37.44 0.81 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 71.42 110.914 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -133.49 -1.13 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 62.51 110.92 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.594 HD12 ' OD1' ' A' ' 117' ' ' ASN . 1.9 pt? -46.91 -48.51 21.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 74.43 110.828 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' N ' ' HG ' ' A' ' 115' ' ' LEU . . . 37.22 30.97 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.792 -0.718 . . . . 53.43 112.474 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.594 ' OD1' HD12 ' A' ' 115' ' ' LEU . 1.4 p-10 -47.5 136.28 10.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 74.24 110.847 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.777 ' HA ' HG13 ' A' ' 121' ' ' VAL . 32.0 ptt180 -158.32 19.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 74.24 110.919 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -68.91 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 74.34 111.133 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.724 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.01 -34.03 7.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.187 -0.461 . . . . 71.32 111.163 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.777 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.62 -42.32 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 62.23 111.124 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.4 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.425 ' N ' HG23 ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.01 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.566 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.03 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.66 ' CB ' HG21 ' A' ' 20' ' ' ILE . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 51.33 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 55.42 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.986 HD13 HD12 ' A' ' 68' ' ' LEU . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.964 ' CG1' HG21 ' A' ' 71' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.33 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.33 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.51 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.643 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.33 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.976 ' CD1' ' HB2' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.41 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.592 HD22 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.13 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.818 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 65.23 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.954 HD21 ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.2 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.792 ' HE1' HD23 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.44 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.48 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 61.44 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.14 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.585 ' HE ' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 64.43 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 34.53 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.828 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.41 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.703 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.43 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 62.23 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.711 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.22 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 62.22 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 54.43 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.33 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.31 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 61.33 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.632 ' SG ' HG12 ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.2 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.33 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.42 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.944 ' HB2' HD11 ' A' ' 41' ' ' LEU . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.496 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.86 151.23 2.25 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 62.41 110.899 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.447 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.2 Cg_endo -69.75 -49.34 0.57 Allowed 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.707 2.271 . . . . 62.24 112.352 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.496 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.5 OUTLIER -58.73 161.87 7.68 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.604 0.716 . . . . 70.43 110.916 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -90.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.717 2.278 . . . . 60.55 112.319 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 mp -100.74 -175.13 2.81 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.246 -0.434 . . . . 54.42 110.891 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.493 ' C ' HG22 ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.25 -1.14 . . . . 33.04 110.25 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.273 -1.131 . . . . 25.2 110.273 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.72 0.66 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.739 2.293 . . . . 73.22 112.335 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' -3' ' ' LEU . 4.7 tp -68.39 -24.24 64.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 73.55 110.939 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -79.0 -72.4 1.19 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 52.32 112.458 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.9 m -99.37 75.24 1.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 70.01 110.888 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -44.48 62.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.21 110.889 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.65 175.6 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 63.24 111.133 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.1 -26.24 12.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 70.11 110.854 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 t -74.65 -19.28 60.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 52.34 110.857 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -84.8 32.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 75.33 110.937 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.496 ' CB ' ' ND1' ' A' ' 9' ' ' HIS . 29.9 m-20 -97.23 146.5 31.46 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.575 0.703 . . . . 74.0 110.838 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -91.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.7 2.267 . . . . 54.2 112.279 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.796 HD12 ' CD1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -111.59 22.12 15.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.945 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.496 ' ND1' ' CB ' ' A' ' 6' ' ' ASP . 1.5 p-80 -62.33 -43.8 97.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.15 110.844 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.479 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 13.4 tt0 -67.38 -36.96 82.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.3 110.812 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.785 HG21 HD11 ' A' ' 136' ' ' LEU . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.51 111.161 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 54.51 110.909 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.785 ' CZ ' HG21 ' A' ' 35' ' ' THR . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.03 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.41 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.97 ' HB3' HG13 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 64.54 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 64.33 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.563 ' OD2' ' HB1' ' A' ' 39' ' ' ALA . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.4 110.954 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.691 ' CZ ' HD12 ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.34 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.695 HD13 HG22 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.53 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.52 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' CE2' ' CG ' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 62.53 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 71.13 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.979 ' HB1' ' CD ' ' A' ' 103' ' ' GLN . . . -81.99 17.19 1.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.13 111.088 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -105.04 112.4 25.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.02 110.884 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -46.66 150.83 1.15 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.33 110.859 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -20.29 35.43 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.669 2.246 . . . . 71.5 112.399 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -76.04 5.63 6.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.207 -0.451 . . . . 73.31 110.895 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -142.94 140.89 18.61 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.621 0.724 . . . . 73.22 111.148 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.75 135.4 30.38 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.644 2.229 . . . . 72.41 112.325 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.586 ' CG ' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -87.12 148.76 45.82 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.65 0.738 . . . . 75.02 110.88 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 166.82 26.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.675 2.25 . . . . 72.11 112.369 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 170.8 15.72 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.65 2.233 . . . . 64.13 112.325 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 172.67 12.17 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.673 2.248 . . . . 74.13 112.336 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.785 HG21 ' CZ ' ' A' ' 14' ' ' ARG . 1.4 m -111.64 -58.26 2.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 64.45 111.117 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.472 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 3.9 m -115.15 172.28 7.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 71.31 110.811 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.447 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.04 111.156 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.34 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.563 ' HB1' ' OD2' ' A' ' 18' ' ' ASP . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 62.04 111.072 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.23 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.62 ' HB3' ' CE2' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 70.24 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.99 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 61.2 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 63.3 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 65.02 110.862 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.746 HG11 ' CD2' ' A' ' 158' ' ' PHE . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.11 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.671 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 74.23 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 72.32 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.646 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 63.14 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.646 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.22 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.1 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.14 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.32 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 61.05 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 47.0 m80 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.14 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.24 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 64.3 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 63.14 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.45 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.24 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.42 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.0 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.414 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.888 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.428 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 51.34 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.53 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.77 ' O ' HD13 ' A' ' 100' ' ' LEU . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 71.54 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.674 ' N ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.04 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.95 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 63.51 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 71.3 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.22 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.782 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 63.21 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.784 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 61.31 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.05 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.923 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.13 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.923 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.897 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.53 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.402 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.837 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.471 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 61.02 110.938 179.945 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.43 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.511 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.02 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.23 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.14 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 61.21 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.965 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.14 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 64.54 110.834 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.528 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.43 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.965 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.14 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.704 HG12 HD11 ' A' ' 42' ' ' LEU . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 53.05 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.589 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.31 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.99 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 61.44 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.924 ' CE2' HD11 ' A' ' 100' ' ' LEU . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.04 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.34 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.03 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.924 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 55.12 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.565 ' CG ' ' HB2' ' A' ' 24' ' ' ALA . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.12 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.456 ' HB3' ' CD ' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -71.45 151.06 44.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.23 110.819 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.979 ' CD ' ' HB1' ' A' ' 24' ' ' ALA . 7.2 mm100 -146.51 122.37 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 72.55 110.882 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.627 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.21 40.68 0.93 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.728 -0.748 . . . . 44.35 112.483 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.9 Cg_endo -69.67 -162.9 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.71 2.273 . . . . 74.43 112.339 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.589 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -116.59 -10.03 11.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 75.54 110.923 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.482 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 20.5 mmt -36.0 95.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.063 -0.517 . . . . 73.03 110.921 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -87.2 -106.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 72.32 111.154 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.489 HG13 ' H ' ' A' ' 110' ' ' LYS . 0.6 OUTLIER -121.01 -55.28 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 63.52 111.184 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.489 ' H ' HG13 ' A' ' 109' ' ' VAL . 1.8 mppt? -108.31 78.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 73.04 110.919 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.447 ' OE1' ' N ' ' A' ' 109' ' ' VAL . 0.0 OUTLIER -107.08 178.38 4.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 73.11 110.967 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -78.97 -171.7 2.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.447 . . . . 73.21 110.905 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -141.57 40.41 1.72 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.935 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -135.04 1.22 2.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 64.21 110.847 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.638 ' H ' HD12 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -97.66 -53.1 3.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 70.5 110.949 -179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 57.18 103.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.779 -0.724 . . . . 72.13 112.447 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 105' ' ' PRO . 5.8 t-20 -37.86 111.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.868 0.366 . . . . 62.43 110.869 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.785 ' HA ' HG13 ' A' ' 121' ' ' VAL . 16.9 mtm180 -153.87 14.36 0.47 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.921 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.4 t -78.04 -68.69 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 74.34 111.149 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.721 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.32 -32.02 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 71.23 111.07 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.785 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -63.01 -43.06 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 62.42 111.09 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.15 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' HG23 ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.1 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.428 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.682 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 55.44 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.95 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.97 HG13 ' HB3' ' A' ' 16' ' ' LEU . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 62.14 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.52 110.888 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.955 HD21 ' HB2' ' A' ' 97' ' ' ALA . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.53 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.43 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 63.22 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.784 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.24 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.962 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.31 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.959 ' N ' HD13 ' A' ' 136' ' ' LEU . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 65.32 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.31 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 52.42 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.471 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 71.22 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 42.4 m80 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 64.55 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.464 ' HD3' ' C ' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 70.14 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 72.22 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.52 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 63.14 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.72 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 53.3 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.41 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.54 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 71.03 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.796 ' CD1' HD12 ' A' ' 8' ' ' LEU . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.44 110.923 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.44 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.42 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.702 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.3 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.528 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.14 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.55 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.43 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.548 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 62.24 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.746 ' CD2' HG11 ' A' ' 45' ' ' VAL . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.43 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.33 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.585 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.65 165.88 0.24 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 61.1 110.846 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.7 Cg_endo -69.84 -50.63 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.681 2.254 . . . . 74.43 112.322 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -99.15 112.77 63.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 60.31 110.902 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -49.86 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.652 2.235 . . . . 74.01 112.363 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.93 176.96 3.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.213 -0.448 . . . . 64.44 110.935 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.322 -1.111 . . . . 64.1 110.322 179.913 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.517 0 N-CA-C 110.264 -1.134 . . . . 73.23 110.264 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -90.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.654 2.236 . . . . 74.44 112.377 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.8 tp 56.65 39.6 29.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.917 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 58.25 -167.01 6.35 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.742 -0.742 . . . . 44.12 112.476 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.1 m -87.04 165.53 15.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 63.04 110.855 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 ptp -91.06 -54.04 4.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.893 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 177.96 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 64.44 111.11 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -122.39 -76.67 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.11 110.807 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -64.11 -24.07 67.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 64.12 110.839 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -100.74 53.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 64.0 110.953 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 5.9 m-20 -52.73 107.64 0.89 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.542 0.687 . . . . 63.33 110.868 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 6' ' ' ASP . 53.8 Cg_endo -69.8 4.83 1.98 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.644 2.23 . . . . 72.3 112.344 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' CD2' ' CD1' ' A' ' 151' ' ' TRP . 0.1 OUTLIER -64.67 -26.04 68.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 74.44 110.912 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -48.07 -81.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 74.44 110.85 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 -59.67 -13.15 8.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 71.3 110.84 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.966 HG21 HD11 ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.41 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.43 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.619 ' HD3' HG21 ' A' ' 35' ' ' THR . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 71.41 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 71.43 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.749 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 54.11 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 64.51 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD2' ' CB ' ' A' ' 35' ' ' THR . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 52.25 110.887 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.666 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 61.03 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.947 HG23 ' HG3' ' A' ' 101' ' ' MET . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 72.04 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.22 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.31 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 63.22 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.54 17.02 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 53.13 111.066 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -119.58 113.14 20.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 64.33 110.831 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -38.79 154.5 0.15 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.638 0.732 . . . . 54.1 110.91 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -13.1 34.33 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.68 2.254 . . . . 72.03 112.413 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -86.83 5.8 34.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 75.24 110.88 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -138.32 141.17 30.74 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.646 0.736 . . . . 62.15 111.105 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 137.54 35.66 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.584 2.189 . . . . 52.14 112.355 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HG2' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.11 162.84 22.49 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.714 0.768 . . . . 74.54 110.852 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.75 23.52 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.661 2.24 . . . . 73.24 112.327 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 170.22 17.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.595 2.197 . . . . 72.24 112.337 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 165.71 29.98 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.715 2.277 . . . . 75.01 112.368 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.619 HG21 ' HD3' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -94.71 -31.69 13.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 73.12 111.106 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.601 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 8.4 m -161.02 -176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 51.31 110.861 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.872 HG13 HD11 ' A' ' 162' ' ' LEU . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.738 ' CG ' HD22 ' A' ' 15' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.13 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.601 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.31 111.143 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.659 ' HB3' HD21 ' A' ' 160' ' ' ASN . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 64.52 111.084 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.752 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.54 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.52 110.903 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.22 110.84 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.785 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.42 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.716 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.21 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.14 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.589 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 73.13 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.589 HD13 ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.44 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 60.54 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.12 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.15 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.51 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.34 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.33 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 70.03 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.43 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.578 ' HE1' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 41.3 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 55.44 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 61.31 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.13 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.21 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.723 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.43 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.642 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 62.3 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 70.31 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.51 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.723 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 72.42 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.782 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 71.45 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.22 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.24 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.744 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.24 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.11 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.24 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.893 ' HG2' HD23 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 65.23 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.893 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.03 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.469 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 70.1 110.877 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.407 ' C ' ' OE1' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.03 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.469 ' HG2' ' CB ' ' A' ' 80' ' ' SER . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 64.04 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.815 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.44 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.02 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 1.034 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.33 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 70.55 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.549 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.034 HD12 ' CE3' ' A' ' 87' ' ' TRP . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.14 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.725 HG11 ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.11 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.453 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.22 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.842 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 63.42 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 51.11 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.716 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 52.11 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.898 ' CE2' HD21 ' A' ' 100' ' ' LEU . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.43 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 54.05 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.431 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.12 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.11 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.995 HD12 HD11 ' A' ' 128' ' ' ILE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.33 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.947 ' HG3' HG23 ' A' ' 20' ' ' ILE . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 44.33 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -92.43 159.2 15.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.911 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.421 ' CD ' ' O ' ' A' ' 102' ' ' ASN . 14.2 mm-40 -137.84 118.39 13.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.959 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.58 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -150.93 43.95 0.69 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.795 -0.716 . . . . 60.41 112.489 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.58 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.76 -162.73 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.623 2.215 . . . . 71.23 112.381 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.515 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -86.94 -16.79 34.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 64.2 110.86 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.69 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 16.1 mmt -36.75 93.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 32.13 110.828 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.68 -153.1 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 70.23 111.109 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.828 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.28 -84.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.01 111.133 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.828 ' N ' HG22 ' A' ' 109' ' ' VAL . 8.8 mttt -71.55 95.2 1.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 74.24 110.818 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.401 ' CD ' ' H ' ' A' ' 108' ' ' ALA . 5.1 mm100 -141.16 -163.32 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 72.23 110.914 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.423 ' HG3' ' N ' ' A' ' 113' ' ' ARG . 3.2 tppp? -169.95 149.1 3.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 64.1 110.892 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.423 ' N ' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -71.26 84.98 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 72.1 110.893 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -115.51 -53.25 2.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 43.15 110.842 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.3 OUTLIER -102.51 -20.6 14.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 75.22 110.953 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.694 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 56.75 114.01 0.01 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.705 -0.76 . . . . 54.33 112.472 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 116' ' ' GLY . 2.1 p30 -32.21 110.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.761 0.315 . . . . 61.41 110.879 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.775 ' HA ' HG13 ' A' ' 121' ' ' VAL . 2.6 ppt_? -154.38 20.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 74.23 110.804 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 122' ' ' THR . 74.5 t -77.91 -68.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 45.52 111.119 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.724 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.83 -33.76 7.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 74.41 111.176 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.775 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -61.5 -42.46 94.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 61.3 111.147 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.537 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 62.23 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.461 ' N ' HG23 ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.912 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.725 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.21 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.3 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 54.13 110.951 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.995 HD11 HD12 ' A' ' 100' ' ' LEU . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.35 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 125' ' ' CYS . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.33 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.3 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.01 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.791 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 71.12 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.21 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 132' ' ' LEU . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 64.41 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.966 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.34 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.871 ' N ' HD13 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.13 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.31 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.03 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 60.44 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.21 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.14 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.423 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 62.04 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.13 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.721 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 62.22 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 63.52 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 73.14 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 52.34 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.43 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.44 ' CD1' ' CD2' ' A' ' 8' ' ' LEU . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.42 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.01 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 71.34 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.725 ' CE1' HG11 ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 70.05 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 55.53 110.914 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.56 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 64.42 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 62.22 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.785 ' CD2' HG11 ' A' ' 45' ' ' VAL . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 65.44 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.455 ' HE3' ' CA ' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 63.44 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.775 ' OD1' HD22 ' A' ' 162' ' ' LEU . 16.5 t-20 -49.16 141.26 11.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.23 110.885 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.476 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.74 -32.19 19.14 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.657 2.238 . . . . 64.41 112.361 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 1.057 ' O ' HD23 ' A' ' 162' ' ' LEU . 0.1 OUTLIER -57.66 161.46 6.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.656 0.741 . . . . 71.34 110.937 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 162' ' ' LEU . 54.2 Cg_endo -69.76 -42.33 3.5 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 55.13 112.373 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.408 ' O ' ' O ' ' A' ' 163' ' ' PRO . 3.1 mp -52.31 -171.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.26 -0.427 . . . . 72.52 110.866 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.552 0 N-CA-C 110.276 -1.13 . . . . 63.2 110.276 179.905 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -5' ' ' GLY . . . . . 0.402 ' CA ' ' H ' ' A' ' 2' ' ' ALA . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 110.289 -1.124 . . . . 54.0 110.289 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 -31.68 19.76 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.666 2.244 . . . . 43.2 112.306 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.6 tp -106.71 105.77 15.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 64.41 110.865 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 55.91 -105.16 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.693 -0.765 . . . . 72.52 112.499 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.3 t -133.93 75.08 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.843 0.354 . . . . 74.12 110.847 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.7 ttm -90.96 -53.95 4.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 51.51 110.888 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.402 ' H ' ' CA ' ' A' ' -5' ' ' GLY . . . -129.67 150.0 51.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 75.33 111.082 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -122.64 -5.96 8.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 64.42 110.849 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.9 m -92.24 -7.69 47.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 51.43 110.814 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -120.51 13.21 11.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 71.31 110.892 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.62 144.52 30.42 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 73.32 110.862 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -163.75 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.639 2.226 . . . . 74.13 112.341 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.03 HD22 ' NH2' ' A' ' 142' ' ' ARG . 0.4 OUTLIER -92.63 -25.98 18.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.25 110.924 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -54.56 -71.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 52.12 110.913 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -56.61 -13.89 2.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 60.45 110.891 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.15 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.811 HG21 HD21 ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 62.32 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.54 110.902 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 63.04 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.753 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.55 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.23 110.937 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 42.14 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.54 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.731 ' CE1' HG21 ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 53.51 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.55 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 72.23 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.1 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.469 ' CD1' ' HB3' ' A' ' 31' ' ' GLU . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 74.12 110.906 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 40.52 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.09 -14.3 22.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 50.32 111.09 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -70.62 111.26 5.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 55.35 110.911 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -41.29 156.44 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.568 0.699 . . . . 73.04 110.917 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -22.25 32.33 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.627 2.218 . . . . 71.32 112.322 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -78.02 4.22 12.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 34.25 110.881 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 29' ' ' THR . 1.5 t -146.03 126.08 6.98 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.546 0.689 . . . . 65.42 111.14 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 136.15 32.2 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.624 2.216 . . . . 63.33 112.359 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 22' ' ' PHE . 32.4 mt-10 -66.48 140.81 96.77 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.628 0.727 . . . . 64.53 110.905 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 171.8 13.81 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.715 2.277 . . . . 74.01 112.301 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 170.29 16.97 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.711 2.274 . . . . 64.22 112.304 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 174.0 10.14 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.717 2.278 . . . . 73.51 112.377 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.32 -34.6 4.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 74.35 111.159 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.569 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 13.2 p -128.16 176.3 7.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 51.44 110.794 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 37' ' ' VAL . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.11 111.154 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 15' ' ' LEU . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 62.12 110.915 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.569 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.14 111.152 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HB1' HD21 ' A' ' 160' ' ' ASN . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.24 111.139 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.896 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.42 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.075 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 65.13 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.457 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.33 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.726 HG11 ' CD2' ' A' ' 158' ' ' PHE . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 65.2 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.731 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.4 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 62.41 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.1 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.577 HG21 ' HG2' ' A' ' 92' ' ' MET . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.34 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 51.1 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.23 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.12 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.612 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 53.0 m80 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.55 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.43 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.13 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.41 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.612 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.24 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.15 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.13 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.14 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.12 110.859 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.4 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.42 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.12 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.41 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.896 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.41 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.812 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 31.24 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.557 HD13 HD13 ' A' ' 127' ' ' LEU . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 74.04 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.896 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.987 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 62.13 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 61.51 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.721 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.11 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.588 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 71.2 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.918 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.42 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.918 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.44 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.867 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.02 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.465 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.42 110.816 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.43 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.539 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 50.3 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 65.3 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.816 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.04 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.3 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.993 ' CE3' HD12 ' A' ' 90' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.21 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.43 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.24 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.993 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.819 HG12 HD23 ' A' ' 42' ' ' LEU . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 62.55 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.577 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.34 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.574 HD11 ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 40.42 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.075 HD23 HD13 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.23 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 62.21 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.987 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.12 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.845 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.21 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.511 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.42 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.677 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 65.31 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.987 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.21 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 20' ' ' ILE . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.51 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER -70.43 161.59 30.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.01 110.903 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -146.02 121.86 10.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 74.12 110.902 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.443 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -175.16 52.87 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.705 -0.759 . . . . 54.12 112.493 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.1 Cg_endo -69.75 -162.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 73.4 112.321 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.606 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.6 t80 -123.86 -6.67 7.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.24 110.918 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.452 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -36.61 94.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.103 -0.499 . . . . 72.23 110.869 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -99.76 -151.13 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.4 111.128 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.616 HG13 ' N ' ' A' ' 110' ' ' LYS . 8.4 p -80.62 -52.66 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 54.3 111.163 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.616 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.7 mptt -85.31 84.06 7.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.914 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -143.72 158.84 43.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.872 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -67.6 -30.36 69.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 63.1 mtm180 -137.21 178.38 7.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 62.34 110.873 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.42 -67.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 62.12 110.893 179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.98 -9.7 47.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 60.14 110.912 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.425 ' N ' HD12 ' A' ' 115' ' ' LEU . . . -79.71 62.21 4.17 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.692 -0.766 . . . . 73.23 112.458 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.612 ' O ' HG11 ' A' ' 121' ' ' VAL . 6.0 p-10 -99.65 68.99 1.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 52.25 110.873 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.782 ' HA ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -113.94 36.6 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.883 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.417 ' O ' HG22 ' A' ' 122' ' ' THR . 70.5 t -79.27 -68.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.267 -0.424 . . . . 75.41 111.195 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.795 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.29 -36.83 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.42 111.103 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.782 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -58.97 -41.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 74.44 111.093 179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.514 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 71.14 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.41 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.531 ' HA ' HD21 ' A' ' 127' ' ' LEU . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.724 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 64.53 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.22 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.998 HD12 ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 73.33 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.998 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.04 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 16' ' ' LEU . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.51 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.32 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 61.25 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.845 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.12 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.48 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.588 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 71.13 110.896 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.811 HD21 HG21 ' A' ' 12' ' ' THR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 65.35 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.2 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.13 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.55 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 60.2 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 71.32 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.718 ' NE2' HD12 ' A' ' 79' ' ' LEU . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 64.42 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 1.03 ' NH2' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.3 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.55 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 44.43 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 63.33 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.903 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 55.45 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.903 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.34 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 34.02 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.1 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.843 ' CD1' HD21 ' A' ' 8' ' ' LEU . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.51 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.448 ' OD1' ' C ' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.34 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 61.51 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.723 ' CE1' HG11 ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.43 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.896 ' HA ' HD23 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 62.1 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.567 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.22 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.34 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.726 ' CD2' HG11 ' A' ' 45' ' ' VAL . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 62.02 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.898 HD22 HD12 ' A' ' 162' ' ' LEU . 1.9 t30 -48.1 146.47 4.31 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 61.13 110.868 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.492 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.2 Cg_endo -69.74 -38.08 8.33 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.716 2.277 . . . . 75.1 112.345 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 1.079 HD13 ' O ' ' A' ' 162' ' ' LEU . 0.0 OUTLIER -58.12 153.09 37.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.6 0.714 . . . . 73.41 110.882 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.698 ' N ' HD22 ' A' ' 162' ' ' LEU . 53.9 Cg_endo -69.76 -89.08 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.64 2.227 . . . . 53.21 112.348 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.921 ' O ' HD23 ' A' ' 164' ' ' LEU . 0.3 OUTLIER -110.99 150.87 28.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 73.14 110.956 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.287 -1.125 . . . . 70.15 110.287 179.935 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.275 -1.13 . . . . 74.01 110.275 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -4' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.74 -90.83 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.676 2.25 . . . . 72.34 112.395 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 5.8 tp 38.78 26.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.33 110.928 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 151.22 33.78 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.739 -0.743 . . . . 62.32 112.451 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.9 m -105.74 106.46 16.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.877 0.37 . . . . 54.45 110.86 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.507 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 1.7 ptt? -90.98 -48.14 7.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 61.52 110.878 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.507 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -169.19 145.86 3.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 54.15 111.018 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -81.91 -52.79 6.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.13 110.84 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 59.5 p -69.21 -33.71 73.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 64.31 110.863 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 38.59 25.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 75.11 110.939 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.7 OUTLIER -71.46 131.78 86.21 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.532 0.682 . . . . 71.02 110.888 179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -15.74 37.24 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.695 2.264 . . . . 75.41 112.327 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.562 HD11 ' HD1' ' A' ' 151' ' ' TRP . 7.0 tp -98.01 -1.18 43.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 75.53 110.893 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.69 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 0.5 OUTLIER -71.62 -54.33 10.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 75.4 110.849 179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.69 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 9.0 tm-20 -74.93 -15.19 60.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 74.44 110.882 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.436 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.12 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.4 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.551 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.909 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.54 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.13 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB3' HG23 ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.13 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.45 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.728 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.31 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.652 HG21 ' HA ' ' A' ' 125' ' ' CYS . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.51 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 32' ' ' PRO . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.4 110.907 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.42 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.877 ' HB1' ' OE1' ' A' ' 103' ' ' GLN . . . -108.85 -11.96 14.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 73.24 111.092 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' CB ' ' CD ' ' A' ' 31' ' ' GLU . 2.9 mmt85 -72.24 113.13 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 64.02 110.82 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' A' ' 25' ' ' ARG . 56.6 mm-40 -28.87 143.01 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.663 0.744 . . . . 62.13 110.884 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 -17.21 37.25 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 71.24 112.352 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.45 4.62 8.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.242 -0.435 . . . . 74.02 110.877 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.451 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.4 t -150.64 124.88 4.52 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.586 0.708 . . . . 75.11 111.178 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 134.87 29.09 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.259 . . . . 60.31 112.4 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -74.33 155.74 87.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 62.52 110.896 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 53.8 Cg_endo -69.78 170.6 16.21 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 2.26 . . . . 64.11 112.315 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 170.96 15.23 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.73 2.287 . . . . 72.45 112.313 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 177.08 5.98 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.624 2.216 . . . . 54.43 112.369 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.54 -28.25 6.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 71.14 111.083 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.456 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.1 p -137.28 166.92 22.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 44.32 110.844 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.12 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 62.31 111.065 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.22 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.952 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.13 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.946 HD22 HD12 ' A' ' 94' ' ' LEU . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.02 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 54.21 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.53 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.648 HG23 ' N ' ' A' ' 46' ' ' THR . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 63.02 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.728 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 53.2 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 61.13 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.54 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.53 HD13 ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.1 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.43 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.22 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.5 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 73.02 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 50.4 m80 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 70.31 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 54.41 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.608 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.55 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 34.15 110.863 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.42 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.21 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.43 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.12 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.34 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.32 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.31 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.937 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.12 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.709 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 65.01 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.05 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 64.12 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.937 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.52 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 1.004 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.52 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 61.02 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.3 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.655 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 72.1 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.507 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.35 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.44 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.32 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.756 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 71.52 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.31 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.925 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.54 110.901 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.54 110.905 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.468 ' HG2' ' CB ' ' A' ' 80' ' ' SER . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 61.25 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.456 ' CG ' ' O ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.1 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.812 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.34 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 63.41 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 63.32 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.12 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.889 ' HA ' HD23 ' A' ' 93' ' ' LEU . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.11 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.79 HG12 HD23 ' A' ' 42' ' ' LEU . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 61.32 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.435 ' HG2' HG21 ' A' ' 49' ' ' ILE . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.52 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.946 HD12 HD22 ' A' ' 42' ' ' LEU . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.33 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.535 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 63.23 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 1.023 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.11 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.47 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.13 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.21 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.023 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 72.44 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.651 ' HG2' ' HB2' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.416 ' O ' ' SD ' ' A' ' 101' ' ' MET . 6.3 p30 -72.91 152.92 41.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 71.13 110.918 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.877 ' OE1' ' HB1' ' A' ' 24' ' ' ALA . 2.9 mm100 -144.46 93.04 2.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 75.0 110.975 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -150.21 71.33 0.3 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.713 -0.756 . . . . 72.03 112.551 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -162.91 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.724 2.283 . . . . 54.25 112.327 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -123.28 -67.91 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.95 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.662 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.32 73.54 1.54 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 62.22 110.851 179.866 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.08 96.9 4.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 52.35 111.109 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 110' ' ' LYS . 11.9 p -151.44 -52.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 52.21 111.119 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.614 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -100.11 77.6 2.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 63.23 110.92 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -133.94 161.28 35.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.23 110.876 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 113' ' ' ARG . 14.1 tptt -131.51 95.0 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 71.24 110.903 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 112' ' ' LYS . 33.1 ttp85 -34.78 97.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.5 110.919 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 112' ' ' LYS . 5.1 t70 -123.78 -57.69 1.62 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 73.53 110.841 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.606 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -99.9 -12.37 19.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.04 110.911 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.606 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 170.52 -138.46 4.99 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.737 . . . . 41.14 112.504 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.632 ' CG ' HG11 ' A' ' 121' ' ' VAL . 3.9 p-10 -110.62 -29.77 7.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.351 . . . . 72.33 110.903 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.876 ' O ' HG22 ' A' ' 122' ' ' THR . 5.0 tpp180 -151.57 171.66 17.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.864 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.501 HG23 ' N ' ' A' ' 120' ' ' ILE . 27.5 m -78.09 -45.23 27.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.465 . . . . 55.44 111.194 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -69.41 -33.34 56.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 73.23 111.138 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.887 ' H ' HD13 ' A' ' 120' ' ' ILE . 5.8 p -71.94 -47.72 54.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 70.15 111.146 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.876 HG22 ' O ' ' A' ' 118' ' ' ARG . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 54.12 111.086 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.837 ' O ' HD13 ' A' ' 127' ' ' LEU . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.35 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.904 ' O ' HG12 ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 53.33 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.15 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 1.004 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.11 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.904 HG12 ' O ' ' A' ' 125' ' ' CYS . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 73.01 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 62.11 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.42 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.21 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.598 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.21 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.507 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 63.04 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.861 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.598 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.21 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.04 112.504 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.42 110.863 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.536 ' HG3' ' CD2' ' A' ' 141' ' ' HIS . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.21 110.942 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.536 ' CD2' ' HG3' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.12 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.496 ' HE ' HD23 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.24 111.152 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.12 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 62.01 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.765 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.33 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.11 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.45 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 44.5 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.34 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' TRP . . . . . 0.562 ' HD1' HD11 ' A' ' 8' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.41 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.1 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 44.43 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.615 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 72.54 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.761 ' HA ' HD23 ' A' ' 41' ' ' LEU . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.42 110.859 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.564 ' C ' ' CD ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 53.51 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 62.44 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.577 ' CD2' HG11 ' A' ' 45' ' ' VAL . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.54 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.34 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.952 ' HA ' HD22 ' A' ' 41' ' ' LEU . 3.8 t30 -48.98 140.15 11.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 60.21 110.923 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.68 -39.09 7.08 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 73.32 112.355 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.4 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 0.5 OUTLIER -102.82 159.2 30.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.616 0.722 . . . . 60.04 110.921 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 -90.35 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.631 2.221 . . . . 71.34 112.331 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.64 -178.53 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 74.41 110.883 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.509 0 N-CA-C 110.247 -1.141 . . . . 72.11 110.247 179.902 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 74.33 110.295 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 -4.29 13.66 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.741 2.294 . . . . 73.15 112.336 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 7.5 tp -44.64 112.95 0.48 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 74.52 110.961 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 151.46 148.64 4.86 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.742 -0.742 . . . . 55.24 112.445 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 t -165.59 116.33 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.902 0.382 . . . . 43.22 110.899 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.492 ' SD ' ' CB ' ' A' ' 2' ' ' ALA . 2.8 ppp? -78.19 -41.7 33.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 64.15 110.851 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.492 ' CB ' ' SD ' ' A' ' 1' ' ' MET . . . -145.46 167.77 22.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 61.21 111.032 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.8 -44.98 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 52.43 110.883 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.04 62.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 73.02 110.858 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.68 -17.8 17.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 71.11 110.923 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CB ' ' HD3' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -110.98 165.96 11.69 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.613 0.721 . . . . 61.45 110.895 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.502 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.3 Cg_endo -69.73 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.238 . . . . 60.4 112.388 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.728 HD22 HH12 ' A' ' 142' ' ' ARG . 0.1 OUTLIER -92.09 -21.5 20.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.938 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 10' ' ' GLU . 9.1 t-80 -59.01 -83.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 74.44 110.837 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.498 ' N ' ' ND1' ' A' ' 9' ' ' HIS . 10.3 tp10 -53.66 -16.66 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.11 110.885 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.502 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.14 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.959 HG21 HD11 ' A' ' 136' ' ' LEU . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.53 111.099 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.1 110.899 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.04 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 55.13 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 94' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 64.51 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.23 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 52.05 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.55 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.12 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.934 HG23 ' HG3' ' A' ' 101' ' ' MET . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 55.33 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.31 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.576 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.41 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 71.45 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.704 ' HB1' ' CG ' ' A' ' 103' ' ' GLN . . . -72.66 -8.46 55.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 65.14 111.115 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' CG ' ' O ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -32.47 111.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 63.5 110.891 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.623 ' HB2' HG22 ' A' ' 29' ' ' THR . 0.0 OUTLIER -49.38 152.09 2.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.67 0.748 . . . . 75.02 110.908 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.71 -8.79 24.51 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.678 2.252 . . . . 61.04 112.377 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.81 5.8 20.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 70.43 110.919 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.623 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.4 t -145.0 139.56 15.29 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.599 0.714 . . . . 72.23 111.089 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 160.68 48.78 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 73.13 112.314 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -78.45 147.73 72.47 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.563 0.697 . . . . 74.43 110.921 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.85 170.05 17.59 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.657 2.238 . . . . 73.24 112.322 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.61 170.09 17.2 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.762 2.308 . . . . 72.43 112.363 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 143.99 52.12 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 71.41 112.336 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -80.98 -58.24 3.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 74.11 111.162 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.535 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -134.05 -177.22 4.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.433 . . . . 74.44 110.921 -179.874 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.418 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.23 111.154 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.731 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 55.14 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 40.33 111.135 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.14 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.67 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 72.23 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.866 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 65.1 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.01 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.01 110.848 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.751 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 72.33 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 62.11 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.34 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.7 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 55.15 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.7 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 65.32 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.11 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.22 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.22 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 56.4 m80 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.24 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.23 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 70.15 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.12 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 72.43 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.34 110.882 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 55.34 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.2 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 45.23 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.53 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.32 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.443 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 64.44 110.803 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.12 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 73.33 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.756 ' O ' HD13 ' A' ' 100' ' ' LEU . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 64.2 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 51.34 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.22 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.568 HD21 ' CE1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.953 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 41.42 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 72.22 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.41 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.672 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.22 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.82 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.01 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.91 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 60.4 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.91 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 55.31 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.802 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 71.13 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.03 110.851 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.482 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 61.23 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.21 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 70.22 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.32 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.828 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.35 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 1.052 ' CE3' HD12 ' A' ' 90' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.2 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 92' ' ' MET . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.21 110.874 -179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.23 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.052 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 53.22 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.721 HG11 ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.02 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.548 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 53.01 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 75' ' ' ALA . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 62.12 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 16' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 55.23 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.725 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.3 111.142 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.979 ' CE2' HD11 ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 71.41 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.41 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 63.53 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.616 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.31 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.979 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 54.31 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.934 ' HG3' HG23 ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.488 ' HB3' ' NE ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -87.57 161.2 17.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.4 110.916 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.704 ' CG ' ' HB1' ' A' ' 24' ' ' ALA . 9.4 mm100 -144.32 131.48 20.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 62.22 110.847 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.629 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.43 41.01 0.9 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 74.3 112.493 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.82 -162.87 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.671 2.247 . . . . 75.02 112.327 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.5 ' O ' ' N ' ' A' ' 108' ' ' ALA . 1.2 p90 -120.67 5.68 10.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 74.34 110.879 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.632 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.3 OUTLIER -33.78 93.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 41.12 110.925 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -85.41 -149.58 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 63.14 111.087 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.84 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.28 -84.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 70.12 111.108 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.84 ' N ' HG22 ' A' ' 109' ' ' VAL . 4.5 mttt -121.28 83.99 2.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 73.31 110.884 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 108' ' ' ALA . 1.4 mp0 -79.13 160.79 26.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 72.02 110.926 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -7.13 21.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 72.42 110.851 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -123.9 147.55 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 55.01 110.865 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -98.66 -50.98 4.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 63.51 110.903 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.484 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -73.0 2.66 6.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.926 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.497 ' O ' ' ND2' ' A' ' 117' ' ' ASN . . . -34.64 107.6 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.76 -0.733 . . . . 20.22 112.527 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.501 ' OD1' ' NE2' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -158.54 126.07 5.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 74.03 110.937 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.953 ' HB3' HD12 ' A' ' 120' ' ' ILE . 22.3 tpt180 -45.87 165.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 73.04 110.858 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.749 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.88 -11.67 14.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 74.43 111.152 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.953 HD12 ' HB3' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -55.11 -29.37 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 65.44 111.06 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.917 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -71.33 -47.43 59.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 74.05 111.105 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.749 ' CG2' HG12 ' A' ' 119' ' ' VAL . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.25 111.153 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.725 ' O ' HD23 ' A' ' 127' ' ' LEU . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.22 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' CYS . . . . . 0.766 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.43 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.01 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.02 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.953 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.45 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 125' ' ' CYS . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.33 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 73.23 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.14 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 55.11 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 70.32 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.03 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.82 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.43 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.003 HD13 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.34 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' MET . . . . . 1.003 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 71.21 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.01 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 52.14 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.482 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.33 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.22 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.728 HH12 HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.44 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 62.44 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.854 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 65.1 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.854 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 65.33 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.01 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 71.34 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.32 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.493 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.11 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.23 110.951 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.31 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 33.34 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.721 ' CE1' HG11 ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.41 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.42 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 156' ' ' ARG . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.45 110.915 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' PHE . . . . . 0.485 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.54 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' PHE . . . . . 0.751 ' CD2' HG11 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 71.42 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.44 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ASN . . . . . 0.53 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.5 t30 -48.78 142.65 8.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 71.53 110.846 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.72 -45.45 1.61 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.738 2.292 . . . . 74.03 112.324 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 163' ' ' PRO . 0.6 OUTLIER -64.74 143.36 98.72 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.567 0.699 . . . . 73.21 110.955 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 163' ' ' PRO . . . . . 0.689 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.9 Cg_endo -69.7 -33.14 17.44 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.608 2.205 . . . . 65.23 112.434 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.45 HD12 ' OXT' ' A' ' 165' ' ' GLY . 0.2 OUTLIER -51.71 145.99 8.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 74.42 110.941 179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.45 ' OXT' HD12 ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.334 0.451 0 N-CA-C 110.269 -1.132 . . . . 64.23 110.269 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.877 0.37 . . . . 75.230000000000004 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 63.340000000000003 110.854 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.944 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.420000000000002 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.230000000000004 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.023 HD13 ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 35.229999999999997 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 51.240000000000002 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.716 ' CE1' HG21 ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.150000000000006 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.537 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 63.409999999999997 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 72.319999999999993 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB2' ' CG ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 61.119999999999997 111.118 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.979 0.419 . . . . 71.010000000000005 110.834 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 64.099999999999994 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 1.023 ' OE1' HD13 ' A' ' 15' ' ' LEU . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.319999999999993 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 111.109 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.901 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.230000000000004 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.136 HD13 HD23 ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.430000000000007 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.520000000000003 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.441 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.219999999999999 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.698 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.728 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HD2' ' N ' ' A' ' 48' ' ' GLN . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.209999999999994 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.497 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.519999999999996 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.299999999999997 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 70.329999999999998 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 75.8 m-70 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 71.450000000000003 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.230000000000004 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.239999999999995 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 72.319999999999993 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.349999999999994 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.400000000000006 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.219999999999999 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.329999999999998 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 61.119999999999997 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.482 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.140000000000001 110.952 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.409999999999997 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.140000000000001 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.71 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 63.420000000000002 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.210000000000001 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.607 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 54.340000000000003 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.719 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 61.240000000000002 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 64.340000000000003 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.239999999999995 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 70.0 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 51.310000000000002 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 73.0 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.439999999999998 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.578 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 64.109999999999999 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.465 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.509999999999998 110.888 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.129999999999995 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 44.109999999999999 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.883 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 71.430000000000007 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 71.430000000000007 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.683 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.210000000000001 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.120000000000005 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.883 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.120000000000005 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.849 HG12 ' CD2' ' A' ' 42' ' ' LEU . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.040000000000006 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.422 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 62.350000000000001 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 93' ' ' LEU . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 74.230000000000004 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.136 HD23 HD13 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 74.010000000000005 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.728 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.340000000000003 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.914 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.319999999999993 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.120000000000005 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 52.439999999999998 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.340000000000003 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.914 HD21 ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 65.120000000000005 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 72.239999999999995 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 44.020000000000003 110.921 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.494 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.913 0.387 . . . . 74.109999999999999 111.161 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.319999999999993 111.167 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.542 ' O ' HD22 ' A' ' 127' ' ' LEU . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 61.539999999999999 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.200000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.611 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.010000000000005 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.542 HD22 ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.230000000000004 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.719 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.1 t-20 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.239999999999995 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 61.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.349999999999994 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.556 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 65.420000000000002 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.944 HD11 HG21 ' A' ' 12' ' ' THR . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.200000000000003 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.717 ' N ' HD12 ' A' ' 136' ' ' LEU . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 32.119999999999997 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 71.129999999999995 110.907 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 61.509999999999998 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.578 ' CE1' ' O ' ' A' ' 80' ' ' SER . 6.6 m-70 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.010000000000005 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.049999999999997 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.135 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.792 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 73.25 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.792 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 43.329999999999998 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.150000000000006 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.683 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.209999999999994 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 70.439999999999998 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.450000000000003 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.239999999999995 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.901 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.450000000000003 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.229999999999997 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.540000000000006 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 71.439999999999998 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.693 ' HB2' HD11 ' A' ' 41' ' ' LEU . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 63.109999999999999 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 53.420000000000002 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 72.420000000000002 110.96 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 73.340000000000003 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 1.038 HG21 HD11 ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 72.340000000000003 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.109999999999999 110.902 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.319999999999993 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.769 HD11 HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.805 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 52.329999999999998 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.319999999999993 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.409999999999997 110.875 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.574 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.693 HG22 ' HG2' ' A' ' 101' ' ' MET . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.010000000000005 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 55.43 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.613 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.340000000000003 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 61.439999999999998 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.453 ' HB2' ' HG3' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.329999999999998 111.117 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.957 0.408 . . . . 54.140000000000001 110.835 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.448 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.450000000000003 111.084 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.725 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 63.119999999999997 111.092 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.010000000000005 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.847 HD12 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.040000000000006 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.868 HD13 HD23 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 71.349999999999994 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 71.319999999999993 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.340000000000003 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.665 HG13 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.766 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 52.409999999999997 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.44 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.430000000000007 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 44.329999999999998 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.109999999999999 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.430000000000007 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.631 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 71.049999999999997 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 44.409999999999997 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 72.219999999999999 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.631 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 64.109999999999999 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 53.140000000000001 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 70.409999999999997 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.040000000000006 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.299999999999997 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.416 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.240000000000002 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.409999999999997 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 72.109999999999999 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.924 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 73.540000000000006 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.739 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.109999999999999 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.200000000000003 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.924 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.040000000000006 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.882 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 54.340000000000003 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.219999999999999 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 64.040000000000006 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.719 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.519999999999996 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 52.229999999999997 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.129999999999995 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.899 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.340000000000003 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.924 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.209999999999994 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.924 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 43.399999999999999 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.452 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 63.409999999999997 110.894 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.474 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.409999999999997 110.923 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.586 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.450000000000003 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.340000000000003 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 64.420000000000002 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.903 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 74.030000000000001 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.350000000000001 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.150000000000006 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 63.140000000000001 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.219999999999999 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.441 HD21 ' CA ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 73.230000000000004 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.868 HD23 HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.439999999999998 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.766 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.409999999999997 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.884 ' CE2' HD11 ' A' ' 100' ' ' LEU . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.439999999999998 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.004 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.574 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 71.420000000000002 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.140000000000001 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.943 HD12 HD11 ' A' ' 128' ' ' ILE . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 64.519999999999996 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.693 ' HG2' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 71.329999999999998 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.495 ' N ' ' O ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.349999999999994 110.901 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.918 0.389 . . . . 73.340000000000003 111.142 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 64.329999999999998 111.087 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 72.010000000000005 110.977 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.523 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.685 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.109999999999999 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.140000000000001 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.943 HD11 HD12 ' A' ' 100' ' ' LEU . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.795 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 71.140000000000001 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 74.129999999999995 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.004 HD11 ' HB2' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.209999999999994 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.566 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.409999999999997 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 43.539999999999999 110.896 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.310000000000002 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.929 ' N ' HD13 ' A' ' 136' ' ' LEU . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 64.310000000000002 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.319999999999993 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.230000000000004 110.853 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.474 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 13.1 m-70 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.509999999999998 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.229999999999997 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 32.100000000000001 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 62.25 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.778 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.030000000000001 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.778 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.140000000000001 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 63.509999999999998 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.140000000000001 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.329999999999998 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.099999999999994 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 51.340000000000003 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.622 ' HB2' ' CZ3' ' A' ' 87' ' ' TRP . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.409999999999997 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.847 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.109999999999999 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.340000000000003 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.708 ' HB2' HD11 ' A' ' 41' ' ' LEU . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.239999999999995 110.954 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 42.509999999999998 110.844 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.828 0.347 . . . . 73.310000000000002 110.868 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.509999999999998 110.91 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 1.047 HG21 HD21 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.400000000000006 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 65.519999999999996 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 63.43 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.731 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.4 ' HA ' HG12 ' A' ' 20' ' ' ILE . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.925 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.239999999999995 110.837 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 64.310000000000002 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.518 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.109999999999999 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.299999999999997 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 111.038 -179.954 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 70.140000000000001 110.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.607 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 54.43 111.106 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.702 ' HB2' HD22 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 53.200000000000003 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 50.109999999999999 111.115 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.129999999999995 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 71.340000000000003 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.449 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 64.420000000000002 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.778 HG11 ' CD2' ' A' ' 158' ' ' PHE . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 61.109999999999999 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.768 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 71.120000000000005 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 70.450000000000003 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.486 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 70.219999999999999 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.519 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.643 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 76.9 m-70 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.030000000000001 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.530000000000001 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.652 ' CB ' HG21 ' A' ' 99' ' ' THR . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.129999999999995 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.510000000000005 110.794 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.200000000000003 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.140000000000001 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 53.43 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 54.310000000000002 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.150000000000006 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.594 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.400000000000006 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.653 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 64.099999999999994 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 44.130000000000003 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 62.32 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 1.023 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.633 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 52.340000000000003 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 73.200000000000003 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.893 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 44.240000000000002 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 70.230000000000004 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.955 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 64.319999999999993 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 70.239999999999995 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 44.119999999999997 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 64.519999999999996 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB2' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 51.409999999999997 110.9 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' SER . 1.1 mp0 -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 52.299999999999997 110.946 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 53.329999999999998 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.541 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 62.509999999999998 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.109999999999999 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.976 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 72.140000000000001 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 55.200000000000003 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 61.020000000000003 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.976 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 52.420000000000002 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.030000000000001 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.432 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 73.150000000000006 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.767 HD23 ' C ' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.219999999999999 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.310000000000002 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.768 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 72.409999999999997 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.933 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.409999999999997 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.82 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 61.210000000000001 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 40.140000000000001 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.399999999999999 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.933 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 64.400000000000006 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 101' ' ' MET . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 45.229999999999997 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.462 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.109999999999999 110.862 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.628 HG13 ' N ' ' A' ' 122' ' ' THR . 7.7 p . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.152 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.628 ' N ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.319999999999993 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 73.209999999999994 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.519999999999996 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.847 ' O ' HG23 ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 62.039999999999999 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.319999999999993 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 1.023 HG12 HG21 ' A' ' 71' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.430000000000007 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 125' ' ' CYS . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 63.420000000000002 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 44.039999999999999 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.633 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.82 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 62.100000000000001 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.679 ' O ' HD23 ' A' ' 136' ' ' LEU . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 54.43 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.893 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 60.130000000000003 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 12' ' ' THR . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 51.350000000000001 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.75 ' N ' HD23 ' A' ' 136' ' ' LEU . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 63.25 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 64.340000000000003 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.329999999999998 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.461 ' CD ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.845 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.099999999999994 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.507 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.140000000000001 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.549999999999997 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.209999999999994 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 63.100000000000001 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.617 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.32 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.319999999999993 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.010000000000005 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.485 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.310000000000002 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CZ2' HD11 ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 64.239999999999995 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.020000000000003 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.340000000000003 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.607 ' SG ' HG12 ' A' ' 37' ' ' VAL . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 53.409999999999997 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.581 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.040000000000006 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.419 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.200000000000003 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.209999999999994 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.479 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 70.230000000000004 110.912 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.841 0.353 . . . . 64.230000000000004 110.897 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.448 ' HD2' ' N ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.977 ' CG2' HD21 ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.329999999999998 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 61.0 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' CD ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 43.520000000000003 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.665 HD11 HD11 ' A' ' 94' ' ' LEU . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.319999999999993 110.958 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 61.149999999999999 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.209999999999994 110.912 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.788 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.510000000000005 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.771 HG23 ' HG3' ' A' ' 101' ' ' MET . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 73.510000000000005 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 71.340000000000003 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 63.109999999999999 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 72.150000000000006 111.067 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.856 0.36 . . . . 70.219999999999999 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.402 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 65.209999999999994 111.177 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.799 ' CD ' HD22 ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.010000000000005 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 111.108 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 50.219999999999999 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.863 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.099999999999994 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.056 HD13 HD23 ' A' ' 94' ' ' LEU . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.310000000000002 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 70.120000000000005 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.438 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.409999999999997 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.639 HG13 ' O ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 51.520000000000003 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.788 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 64.430000000000007 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.129999999999995 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.493 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.229999999999997 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.200000000000003 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.572 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.030000000000001 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.613 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.7 m-70 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 73.209999999999994 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.430000000000007 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.219999999999999 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.340000000000003 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.907 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.010000000000005 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 110.832 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 65.230000000000004 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 55.229999999999997 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.401 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.209999999999994 110.878 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.340000000000003 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 71.340000000000003 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.752 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 61.340000000000003 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 70.230000000000004 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.239999999999995 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 53.340000000000003 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.843 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 64.319999999999993 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.099999999999994 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.530000000000001 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.838 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 73.200000000000003 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.659 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.010000000000005 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.921 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 60.520000000000003 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.921 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.129999999999995 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.907 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.140000000000001 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.459 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.510000000000005 110.847 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 55.43 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.210000000000001 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 60.409999999999997 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.329999999999998 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.619 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 71.150000000000006 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 71.129999999999995 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.409999999999997 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 62.210000000000001 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 64.019999999999996 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.619 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.844 HG12 HD23 ' A' ' 42' ' ' LEU . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.040000000000006 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.424 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.299999999999997 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.82 HD11 HD22 ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 45.009999999999998 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.056 HD23 HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 72.329999999999998 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 53.520000000000003 111.126 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.934 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 73.030000000000001 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.117 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 53.229999999999997 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.439999999999998 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.667 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.934 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 72.340000000000003 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.771 ' HG3' HG23 ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 60.0 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.329999999999998 110.904 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.514 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.867 0.365 . . . . 73.109999999999999 111.158 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.439999999999998 111.149 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.319999999999993 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 70.540000000000006 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.872 HD11 HD12 ' A' ' 100' ' ' LEU . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 62.219999999999999 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 125' ' ' CYS . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.039999999999999 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.530000000000001 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.120000000000005 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.117 HD11 ' HB2' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.540000000000006 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.405 ' HB3' ' O ' ' A' ' 129' ' ' VAL . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.540000000000006 110.926 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 64.430000000000007 110.904 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.659 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 53.219999999999999 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.977 HD21 ' CG2' ' A' ' 12' ' ' THR . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 60.219999999999999 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.54 ' N ' HD12 ' A' ' 136' ' ' LEU . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.230000000000004 110.912 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.430000000000007 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.432 ' CB ' ' HE ' ' A' ' 140' ' ' ARG . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.439999999999998 110.9 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 63.210000000000001 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.598 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 71.019999999999996 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.475 ' O ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.409999999999997 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.420000000000002 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 54.329999999999998 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.852 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.049999999999997 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.540000000000006 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 53.039999999999999 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 24.120000000000001 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.407 ' C ' ' O ' ' A' ' 150' ' ' GLY . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.310000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 61.310000000000002 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 71.340000000000003 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.728 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.310000000000002 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.574 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.408 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 62.020000000000003 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HB2' HD11 ' A' ' 41' ' ' LEU . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.010000000000005 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 64.329999999999998 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 2.7 t30 . . . . . 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 55.140000000000001 110.901 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.799 0.333 . . . . 60.439999999999998 110.844 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 1.103 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.430000000000007 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.219999999999999 110.925 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 70.329999999999998 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.239999999999995 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.891 ' HB3' HG13 ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.402 ' HA ' HG12 ' A' ' 20' ' ' ILE . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 42.109999999999999 110.874 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.757 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 64.25 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' SD ' ' A' ' 101' ' ' MET . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 53.039999999999999 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.633 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.240000000000002 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.549999999999997 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 62.43 111.09 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.916 0.389 . . . . 73.209999999999994 110.805 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 111.145 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.848 ' O ' HD22 ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.150000000000006 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.400000000000006 111.058 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.130000000000003 111.12 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.741 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 62.329999999999998 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 50.119999999999997 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.89 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 63.409999999999997 110.922 -179.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.684 HG11 ' HD2' ' A' ' 158' ' ' PHE . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 71.040000000000006 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.757 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.039999999999999 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.625 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 65.519999999999996 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.549999999999997 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.579 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.239999999999995 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.9 m-70 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.150000000000006 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.030000000000001 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 64.409999999999997 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.340000000000003 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 53.43 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 63.329999999999998 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 64.319999999999993 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.453 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 62.130000000000003 110.864 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 61.420000000000002 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.941 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.340000000000003 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.75 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 60.329999999999998 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 55.229999999999997 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.941 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.637 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.239999999999995 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.349999999999994 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.439999999999998 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.796 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.779 ' HB1' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 41.409999999999997 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.895 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.450000000000003 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 43.509999999999998 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 62.439999999999998 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.42 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.310000000000002 110.885 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.566 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.540000000000006 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.411 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 53.109999999999999 110.826 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.612 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 64.5 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.751 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 70.310000000000002 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 1.075 ' CZ3' HD12 ' A' ' 90' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.230000000000004 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 72.129999999999995 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.075 HD12 ' CZ3' ' A' ' 87' ' ' TRP . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 71.230000000000004 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.817 HG12 HD11 ' A' ' 42' ' ' LEU . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 63.340000000000003 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.625 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.491 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.519999999999996 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.569 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 71.099999999999994 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.340000000000003 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.015 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.400000000000006 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.140000000000001 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 74.430000000000007 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.925 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.319999999999993 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.791 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 54.439999999999998 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.511 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 54.420000000000002 110.971 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.492 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.919 0.39 . . . . 63.119999999999997 111.144 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.555 HG23 ' N ' ' A' ' 123' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 55.43 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.555 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.409999999999997 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.6 ' HA ' HD21 ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.129999999999995 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.743 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 60.240000000000002 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.965 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 64.340000000000003 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.965 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.891 HG13 ' HB3' ' A' ' 16' ' ' LEU . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 51.329999999999998 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 63.439999999999998 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.030000000000001 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.015 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 73.510000000000005 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.514 ' CE2' ' HB2' ' A' ' 13' ' ' ARG . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.779 ' CD1' ' HB1' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 71.239999999999995 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.103 HD11 HG21 ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.319999999999993 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.310000000000002 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 62.020000000000003 110.892 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.566 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 62.109999999999999 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.723 ' NH1' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 61.210000000000001 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.85 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.030000000000001 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.809 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.340000000000003 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.665 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.030000000000001 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 34.130000000000003 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 64.549999999999997 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.099999999999994 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 51.100000000000001 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.639 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.741 ' HA ' HD23 ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.530000000000001 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.556 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HD2' HG11 ' A' ' 45' ' ' VAL . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 63.350000000000001 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.575 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.140000000000001 110.933 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.865 0.364 . . . . 74.140000000000001 110.895 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.209999999999994 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.646 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 53.140000000000001 110.919 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.829 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.842 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.430000000000007 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.459 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.140000000000001 110.842 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.239999999999995 110.864 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.764 ' CE1' HG21 ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 54.340000000000003 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.885 HG22 ' SD ' ' A' ' 101' ' ' MET . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 60.32 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.239999999999995 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 55.409999999999997 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 111.044 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.919 0.39 . . . . 45.5 110.875 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.209999999999994 111.077 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.614 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.140000000000001 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 61.450000000000003 111.097 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.409999999999997 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.944 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.239999999999995 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.003 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.209999999999994 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.430000000000007 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.239999999999995 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.687 HG23 ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 72.209999999999994 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 51.340000000000003 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.575 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 73.299999999999997 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.149999999999999 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.530000000000001 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.329999999999998 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.623 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.329999999999998 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 70.109999999999999 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.140000000000001 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 63.420000000000002 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 62.409999999999997 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.319999999999993 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 71.439999999999998 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 61.450000000000003 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.439999999999998 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.451 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 63.140000000000001 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.329999999999998 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 54.439999999999998 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.81 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 71.120000000000005 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.140000000000001 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 54.549999999999997 110.923 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.96 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 44.32 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.703 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 64.129999999999995 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 62.020000000000003 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.853 ' HG3' HD23 ' A' ' 78' ' ' LEU . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 43.310000000000002 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.86 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.230000000000004 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.86 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 61.399999999999999 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.409999999999997 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 60.350000000000001 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 43.43 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.734 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 70.120000000000005 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.81 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.530000000000001 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.439999999999998 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 1.073 ' CE3' HD12 ' A' ' 90' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' MET . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.109999999999999 110.838 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.506 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.129999999999995 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.073 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.785 HG11 ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.575 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 63.240000000000002 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.835 HD11 ' HB2' ' A' ' 75' ' ' ALA . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.420000000000002 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.003 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.109999999999999 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.789 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 1.004 ' CE2' HD11 ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.230000000000004 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.025 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.150000000000006 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.230000000000004 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.633 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.409999999999997 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.004 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 61.329999999999998 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.885 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 62.229999999999997 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.503 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 74.200000000000003 110.847 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.919 0.39 . . . . 73.239999999999995 111.143 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.415 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 72.25 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.415 ' N ' HG23 ' A' ' 122' ' ' THR . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.899 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.040000000000006 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.687 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 71.549999999999997 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.239999999999995 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 64.25 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.96 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.409999999999997 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.842 HG13 ' HB3' ' A' ' 16' ' ' LEU . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 74.400000000000006 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.506 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 70.439999999999998 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.025 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.400000000000006 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.599 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 60.149999999999999 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.451 ' ND2' ' C ' ' A' ' 134' ' ' ASN . 0.4 OUTLIER -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.824 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.735 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.040000000000006 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.530000000000001 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.049999999999997 112.492 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.420000000000002 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 64.310000000000002 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.420000000000002 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.646 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.812 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.793 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 64.420000000000002 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.239999999999995 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 42.210000000000001 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 62.240000000000002 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.449 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 54.049999999999997 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.508 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.230000000000004 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.119999999999997 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.019999999999996 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.944 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.109999999999999 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.722 ' HA ' HD12 ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.150000000000006 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.692 ' HB2' HD11 ' A' ' 41' ' ' LEU . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.439999999999998 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 71.319999999999993 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.510000000000005 110.918 179.903 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' CD ' ' O ' ' A' ' 10' ' ' GLU . 15.1 tm-20 . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.91 0.386 . . . . 73.319999999999993 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.210000000000001 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.91 HG21 HD11 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.240000000000002 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.788 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.519999999999996 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.430000000000007 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.632 ' CE1' HG21 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.329999999999998 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.886 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 71.099999999999994 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.329999999999998 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.639 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.010000000000005 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.075 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.3 m . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.843 0.354 . . . . 72.140000000000001 110.888 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 51.43 111.145 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.739 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 73.530000000000001 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.049999999999997 111.121 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 61.140000000000001 111.157 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.816 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 71.120000000000005 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.431 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 70.5 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.762 HG11 ' CD2' ' A' ' 158' ' ' PHE . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 71.239999999999995 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.733 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.319999999999993 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.329999999999998 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.030000000000001 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.511 HD13 ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.240000000000002 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.319999999999993 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.349999999999994 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.605 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.010000000000005 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.310000000000002 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.130000000000003 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.605 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.099999999999994 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.409999999999997 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 62.049999999999997 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 61.200000000000003 110.886 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.219999999999999 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.549999999999997 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 63.049999999999997 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.310000000000002 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.319999999999993 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.784 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 72.450000000000003 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.439999999999998 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 63.409999999999997 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.902 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 72.439999999999998 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.540000000000006 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.349999999999994 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.634 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.109999999999999 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.875 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 52.219999999999999 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 70.019999999999996 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.868 ' HG3' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 55.009999999999998 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.928 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.409999999999997 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.928 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.319999999999993 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.468 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.340000000000003 110.838 -179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HB2' ' CZ ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 64.400000000000006 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.299999999999997 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 55.399999999999999 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.891 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.430000000000007 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.119999999999997 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.721 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.340000000000003 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.239999999999995 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.891 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.75 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 65.310000000000002 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.875 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.430000000000007 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD13 ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 73.040000000000006 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.733 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.520000000000003 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 1.001 ' CE2' HD11 ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.045 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.545 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.319999999999993 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.641 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 61.549999999999997 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.001 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 63.149999999999999 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.886 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.040000000000006 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.955 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.867 0.365 . . . . 63.539999999999999 111.114 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.475 HG23 ' N ' ' A' ' 123' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.536 ' O ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.019999999999996 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.129999999999995 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.792 ' O ' HG23 ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.299999999999997 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.230000000000004 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 123' ' ' ARG . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.902 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.941 HD11 HD12 ' A' ' 100' ' ' LEU . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 61.030000000000001 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 125' ' ' CYS . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.030000000000001 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.045 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.219999999999999 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.568 ' O ' HD12 ' A' ' 136' ' ' LEU . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 60.009999999999998 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.479 HD23 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 64.140000000000001 110.887 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.91 HD11 HG21 ' A' ' 12' ' ' THR . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 60.420000000000002 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.58 ' HA ' ' HE2' ' A' ' 137' ' ' MET . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.099999999999994 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 71.349999999999994 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.519999999999996 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 64.340000000000003 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.468 ' CE1' ' O ' ' A' ' 80' ' ' SER . 25.5 m-70 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 70.109999999999999 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 54.340000000000003 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.492 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.129999999999995 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.522 ' NH2' ' HB1' ' A' ' 147' ' ' ALA . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.539999999999999 110.791 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.815 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 62.039999999999999 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.739 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 52.439999999999998 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.522 ' HB1' ' NH2' ' A' ' 144' ' ' ARG . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 55.009999999999998 111.142 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.721 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 60.350000000000001 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 64.239999999999995 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 72.340000000000003 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.52 ' CH2' HD22 ' A' ' 136' ' ' LEU . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.340000000000003 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.349999999999994 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 73.140000000000001 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.75 ' CE1' HG11 ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 62.25 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.493 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 55.020000000000003 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.58 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 62.5 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 53.310000000000002 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.816 ' CB ' HD11 ' A' ' 41' ' ' LEU . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.439999999999998 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.712 ' HB2' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.209999999999994 110.842 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.91 0.386 . . . . 70.209999999999994 110.948 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.818 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 73.409999999999997 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.493 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.859 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 62.409999999999997 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 65.319999999999993 110.842 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 25.210000000000001 110.825 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 70.420000000000002 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.568 HG21 ' CB ' ' A' ' 125' ' ' CYS . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.219999999999999 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 71.409999999999997 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.638 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.59 ' CB ' HG21 ' A' ' 121' ' ' VAL . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.119999999999997 111.097 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.933 0.397 . . . . 61.420000000000002 110.854 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.452 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 72.310000000000002 111.197 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.673 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.109999999999999 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.200000000000003 111.124 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 53.130000000000003 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.836 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 62.219999999999999 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.82 HD11 HG12 ' A' ' 91' ' ' VAL . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 72.349999999999994 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 65.129999999999995 110.875 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.773 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 72.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.771 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 43.020000000000003 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.566 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.566 HD13 ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.120000000000005 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.019999999999996 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 53.130000000000003 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.8 m-70 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.549999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.019999999999996 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.450000000000003 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.119999999999997 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 54.240000000000002 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.963 ' CE1' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.109999999999999 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 71.5 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.019999999999996 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 70.219999999999999 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 14.539999999999999 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.329999999999998 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.673 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.655 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.963 HD23 ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.701 HG23 ' CD1' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.219999999999999 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.681 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 70.019999999999996 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 60.420000000000002 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.409999999999997 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.888 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.942 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 63.399999999999999 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.510000000000005 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.420000000000002 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.532 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.340000000000003 110.861 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.319999999999993 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.801 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.319999999999993 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.704 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.340000000000003 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 72.340000000000003 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.801 HD21 ' CD2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 64.200000000000003 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.82 HG12 HD11 ' A' ' 42' ' ' LEU . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.030000000000001 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.019999999999996 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.666 HD11 HD22 ' A' ' 132' ' ' LEU . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.420000000000002 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.803 HD12 ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.319999999999993 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.771 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 52.130000000000003 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.828 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 71.109999999999999 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.111 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 54.530000000000001 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.239999999999995 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.663 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.519999999999996 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.839 HD12 HD11 ' A' ' 128' ' ' ILE . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 71.319999999999993 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.239999999999995 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.310000000000002 110.882 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.606 HG13 ' N ' ' A' ' 122' ' ' THR . 6.7 p . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.876 0.37 . . . . 63.240000000000002 111.114 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.606 ' N ' HG13 ' A' ' 121' ' ' VAL . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.120000000000005 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.140000000000001 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.543 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.119999999999997 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.938 HD12 ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 61.350000000000001 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.938 ' N ' HD12 ' A' ' 127' ' ' LEU . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.472 ' ND2' ' C ' ' A' ' 130' ' ' ASN . 0.3 OUTLIER -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.439999999999998 110.911 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.111 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 72.120000000000005 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.582 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.349999999999994 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.340000000000003 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.535 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.299999999999997 110.93 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.595 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.009999999999998 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.595 ' HE2' HD12 ' A' ' 136' ' ' LEU . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.210000000000001 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.400000000000006 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.501 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 71.200000000000003 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 70.420000000000002 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 64.439999999999998 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 72.540000000000006 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 72.510000000000005 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.816 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.129999999999995 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.741 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.099999999999994 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.704 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.030000000000001 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.450000000000003 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.409999999999997 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.453 ' HZ2' HD11 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.239999999999995 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.530000000000001 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 63.399999999999999 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.230000000000004 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.562 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.409999999999997 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 73.0 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.836 ' CB ' HD11 ' A' ' 41' ' ' LEU . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.409999999999997 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 53.130000000000003 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.611 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.1 t30 . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 65.030000000000001 110.888 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.833 0.349 . . . . 71.420000000000002 110.861 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.310000000000002 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 1.039 HG21 HD21 ' A' ' 136' ' ' LEU . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.040000000000006 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 73.219999999999999 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 70.109999999999999 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.739 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 53.539999999999999 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 44.210000000000001 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.458 ' HA ' HG21 ' A' ' 129' ' ' VAL . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.230000000000004 110.868 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 73.450000000000003 110.845 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 46' ' ' THR . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 64.25 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.525 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 62.240000000000002 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.510000000000005 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.120000000000005 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.409999999999997 111.121 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.858 0.361 . . . . 65.310000000000002 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.435 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 64.219999999999999 111.122 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.736 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.420000000000002 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 72.129999999999995 111.073 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.219999999999999 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.88 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.219999999999999 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.32 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.673 HG23 ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.872 ' HB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.439999999999998 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.552 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.450000000000003 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.552 HD13 ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.329999999999998 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 62.520000000000003 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.299999999999997 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.528 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 62.539999999999999 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.3 m-70 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.409999999999997 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 64.329999999999998 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 71.409999999999997 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.239999999999995 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.109999999999999 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 54.439999999999998 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.420000000000002 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 63.140000000000001 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.030000000000001 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.845 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.209999999999994 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.74 ' O ' HD13 ' A' ' 100' ' ' LEU . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 54.439999999999998 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.983 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 71.319999999999993 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.430000000000007 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.5 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.709 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.909 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 53.119999999999997 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.230000000000004 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.858 ' HG2' HD23 ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 52.439999999999998 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.913 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.530000000000001 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.913 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 70.510000000000005 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.768 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.340000000000003 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.431 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 53.240000000000002 110.83 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.599 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 60.450000000000003 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.150000000000006 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.439999999999998 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.899 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 73.120000000000005 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 73.209999999999994 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 54.210000000000001 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.899 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 71.340000000000003 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.548 HG11 ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 64.540000000000006 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.433 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.120000000000005 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.129999999999995 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.762 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.984 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.814 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.420000000000002 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.514 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.530000000000001 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.657 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.409999999999997 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.984 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 54.200000000000003 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.040000000000006 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.439999999999998 110.948 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.899 0.38 . . . . 71.230000000000004 111.121 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.593 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.120000000000005 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.593 ' N ' HG23 ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.310000000000002 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.48 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.878 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.671 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.219999999999999 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.0 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.983 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.140000000000001 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 70.239999999999995 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 71.519999999999996 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.814 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 44.450000000000003 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.77 ' O ' HD23 ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.319999999999993 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 64.239999999999995 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.909 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.329999999999998 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 12' ' ' THR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.558 ' N ' HD23 ' A' ' 136' ' ' LEU . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.905 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.319999999999993 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.450000000000003 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.299999999999997 110.826 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 61.25 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.340000000000003 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.841 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.530000000000001 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.841 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 71.420000000000002 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.5 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.439999999999998 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.491 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.200000000000003 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.239999999999995 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 157' ' ' PHE . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.509999999999998 112.494 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.88 ' CE1' HD13 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.209999999999994 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.796 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 62.299999999999997 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 64.450000000000003 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.409999999999997 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.78 ' HB2' HD11 ' A' ' 41' ' ' LEU . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.219999999999999 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 63.420000000000002 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 72.340000000000003 110.9 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.795 0.331 . . . . 71.209999999999994 110.844 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.547 ' CG2' HD11 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 71.430000000000007 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.806 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 64.329999999999998 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.888 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.655 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 110.93 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 72.120000000000005 110.815 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.439999999999998 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' HG21 ' A' ' 46' ' ' THR . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.510000000000005 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.782 HG21 ' CB ' ' A' ' 125' ' ' CYS . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.409999999999997 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.349999999999994 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.135 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.93 0.395 . . . . 73.209999999999994 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 37' ' ' VAL . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.161 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 61.119999999999997 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.140000000000001 111.048 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.140000000000001 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 71.450000000000003 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 64.340000000000003 110.842 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 73.519999999999996 110.85 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.841 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 64.549999999999997 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.784 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 72.049999999999997 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 51.509999999999998 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.039999999999999 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.579 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.099999999999994 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.450000000000003 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 62.329999999999998 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.549 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.632 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 64.2 m-70 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 71.420000000000002 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.109999999999999 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.030000000000001 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.409999999999997 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.340000000000003 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.340000000000003 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.400000000000006 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.310000000000002 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.510000000000005 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.310000000000002 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.130000000000003 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.310000000000002 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.662 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.109999999999999 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.716 ' HB2' HD13 ' A' ' 127' ' ' LEU . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 73.140000000000001 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.400000000000006 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.595 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.865 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.439999999999998 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 73.540000000000006 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 51.229999999999997 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.5 ' CB ' HD11 ' A' ' 93' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 50.240000000000002 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.140000000000001 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HG3' HD23 ' A' ' 78' ' ' LEU . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.937 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.937 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.430000000000007 110.86 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.219999999999999 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.530000000000001 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 72.239999999999995 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.421 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.120000000000005 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.965 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 53.030000000000001 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 62.43 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 73.010000000000005 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 92' ' ' MET . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 65.540000000000006 110.849 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 63.409999999999997 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.965 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 65.310000000000002 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.691 HG11 ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 74.310000000000002 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.426 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.140000000000001 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.67 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 65.420000000000002 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.784 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 62.310000000000002 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.938 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 72.519999999999996 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.114 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.528 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.450000000000003 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.010000000000005 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.938 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.458 ' HE1' ' HB2' ' A' ' 124' ' ' ASP . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.439999999999998 110.859 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.984 0.421 . . . . 74.329999999999998 111.176 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 111.144 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.310000000000002 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 127' ' ' LEU . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.439999999999998 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.782 ' CB ' HG21 ' A' ' 20' ' ' ILE . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.964 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.964 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 64.409999999999997 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 125' ' ' CYS . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.150000000000006 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 64.319999999999993 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.114 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 61.549999999999997 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.239999999999995 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 65.409999999999997 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.450000000000003 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.129999999999995 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.049999999999997 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.049999999999997 110.922 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.502 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.340000000000003 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.66 ' NE2' HD11 ' A' ' 90' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.219999999999999 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 61.310000000000002 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.509999999999998 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.838 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 73.510000000000005 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.756 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.239999999999995 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.530000000000001 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.340000000000003 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 71.439999999999998 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 45.009999999999998 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.443 ' CZ2' ' CD1' ' A' ' 136' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.319999999999993 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.430000000000007 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.540000000000006 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 72.209999999999994 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 61.439999999999998 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.495 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.099999999999994 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.450000000000003 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.841 ' CD2' HG11 ' A' ' 45' ' ' VAL . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 53.0 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.129999999999995 110.899 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.804 0.335 . . . . 72.109999999999999 110.888 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.405 HH21 ' CZ ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.319999999999993 110.928 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.473 HG22 ' HD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.519999999999996 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.403 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.92 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 70.209999999999994 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 45.310000000000002 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 61.140000000000001 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.515 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.120000000000005 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.601 ' CE2' HG21 ' A' ' 46' ' ' THR . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.329999999999998 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.917 HG22 ' SD ' ' A' ' 101' ' ' MET . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 53.329999999999998 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.87 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.647 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 73.319999999999993 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 43.030000000000001 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.46 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 34.109999999999999 111.082 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.3 m . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.962 0.411 . . . . 61.509999999999998 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 37' ' ' VAL . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 64.519999999999996 111.045 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.929 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.219999999999999 110.848 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.239999999999995 111.171 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.445 ' CB ' HD21 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 53.310000000000002 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.129999999999995 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.688 ' CD1' HG12 ' A' ' 91' ' ' VAL . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.129999999999995 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.845 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.669 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 70.400000000000006 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.597 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.400000000000006 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.597 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 62.140000000000001 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 65.129999999999995 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.617 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.0 m-70 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 64.310000000000002 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 52.509999999999998 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.209999999999994 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.617 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.409999999999997 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 30.440000000000001 110.808 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.230000000000004 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 55.009999999999998 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.418 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.210000000000001 110.861 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.540000000000006 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.430000000000007 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.885 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.129999999999995 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.811 ' O ' HD13 ' A' ' 100' ' ' LEU . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 73.200000000000003 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.310000000000002 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 70.430000000000007 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.885 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 72.0 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 1.026 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.040000000000006 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 72.120000000000005 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.120000000000005 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.711 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.219999999999999 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 1.102 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 41.509999999999998 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.450000000000003 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.903 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 65.319999999999993 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 62.32 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.420000000000002 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 64.120000000000005 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 72.519999999999996 110.898 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 65.219999999999999 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.614 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.319999999999993 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 63.439999999999998 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.797 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 70.219999999999999 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 70.230000000000004 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.731 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.409999999999997 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 71.209999999999994 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.797 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 53.030000000000001 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.712 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 62.409999999999997 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.535 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.540000000000006 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.819 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 71.239999999999995 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.577 HD11 HD11 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 1.032 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.809 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.450000000000003 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.586 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.329999999999998 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.032 HD11 ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 54.329999999999998 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.917 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.469 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.219999999999999 110.876 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.777 HG23 ' SD ' ' A' ' 101' ' ' MET . 2.5 p . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.928 0.394 . . . . 54.399999999999999 111.134 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.408 ' N ' HG13 ' A' ' 121' ' ' VAL . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 111.113 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.409999999999997 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 63.109999999999999 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.673 ' O ' HG23 ' A' ' 129' ' ' VAL . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.230000000000004 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 54.340000000000003 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.5 ' N ' ' CD1' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 73.299999999999997 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 1.026 ' CG1' HG21 ' A' ' 71' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.530000000000001 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.779 HG13 ' HB3' ' A' ' 16' ' ' LEU . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.439999999999998 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 44.149999999999999 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 54.149999999999999 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.809 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD1' ' HG3' ' A' ' 137' ' ' MET . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 63.25 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 1.102 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.140000000000001 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.521 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.230000000000004 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.569 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 71.430000000000007 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 42.310000000000002 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.140000000000001 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.540000000000006 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.43 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 65.439999999999998 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 147' ' ' ALA . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.430000000000007 111.142 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 71.510000000000005 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.827 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 72.049999999999997 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.742 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 73.519999999999996 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 143' ' ' ALA . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.109999999999999 111.103 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.731 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 43.509999999999998 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.239999999999995 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.340000000000003 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.299999999999997 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 64.140000000000001 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.712 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.120000000000005 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.767 ' HA ' HD23 ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 70.230000000000004 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.120000000000005 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.464 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.845 ' CD2' HG11 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.349999999999994 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.456 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.617 ' OD1' HD22 ' A' ' 41' ' ' LEU . 2.0 t30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.099999999999994 110.913 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.858 0.361 . . . . 74.510000000000005 110.927 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.510000000000005 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.611 HG21 HD11 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.530000000000001 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.486 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.129999999999995 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.699 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 72.019999999999996 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.522 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 65.129999999999995 110.819 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.010000000000005 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 63.340000000000003 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.631 HG22 ' HE3' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.120000000000005 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.030000000000001 110.92 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 73.319999999999993 111.12 179.965 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.947 0.403 . . . . 72.510000000000005 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.329999999999998 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 55.32 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 70.25 111.132 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.239999999999995 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.439999999999998 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 72.230000000000004 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.488 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.130000000000003 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 73.040000000000006 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.586 HG23 ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.772 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.519999999999996 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.040000000000006 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 74.099999999999994 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.583 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.7 m-70 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.319999999999993 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 64.129999999999995 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 70.030000000000001 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.519999999999996 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 71.420000000000002 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 41.100000000000001 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.239999999999995 110.875 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.140000000000001 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.010000000000005 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 64.319999999999993 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.049999999999997 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.541 HD21 ' HE1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.329999999999998 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.82 HG22 HD21 ' A' ' 132' ' ' LEU . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 70.430000000000007 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HE2' ' CE1' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 70.409999999999997 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.532 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.319999999999993 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.745 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.877 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 61.439999999999998 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.932 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 62.009999999999998 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.932 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.510000000000005 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.549999999999997 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.409999999999997 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.049999999999997 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.837 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.040000000000006 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.694 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 64.329999999999998 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.240000000000002 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.52 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 60.439999999999998 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 63.450000000000003 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.448 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.310000000000002 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 1.09 HD11 HD22 ' A' ' 132' ' ' LEU . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 70.409999999999997 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.792 HD13 HD13 ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.019999999999996 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.772 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.519999999999996 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 1.002 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 1.064 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 43.140000000000001 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 12.23 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.002 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.631 ' HE3' HG22 ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.129999999999995 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 65.239999999999995 110.863 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.491 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.927 0.394 . . . . 71.099999999999994 111.126 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.545 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 62.119999999999997 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.545 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.150000000000006 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 128' ' ' ILE . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 72.519999999999996 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.120000000000005 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.200000000000003 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 63.210000000000001 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.787 ' CG1' HG21 ' A' ' 71' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.219999999999999 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.699 HG13 ' HB3' ' A' ' 16' ' ' LEU . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.531 HD22 ' N ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.299999999999997 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.609 ' CE1' ' HE2' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 1.09 HD22 HD11 ' A' ' 93' ' ' LEU . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.409999999999997 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.319999999999993 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 54.420000000000002 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.877 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.409999999999997 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.611 HD11 HG21 ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 71.109999999999999 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.513 ' HE3' ' CD1' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 62.43 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.150000000000006 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 71.430000000000007 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.497 ' CD ' ' C ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.47 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.540000000000006 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 35.450000000000003 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.52 ' HD2' HD23 ' A' ' 148' ' ' LEU . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.510000000000005 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.319999999999993 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.701 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.450000000000003 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.469 ' HB3' ' HD3' ' A' ' 144' ' ' ARG . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.019999999999996 111.135 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 63.140000000000001 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.530000000000001 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 73.310000000000002 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 71.530000000000001 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.229999999999997 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.715 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.530000000000001 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.210000000000001 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.578 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 64.409999999999997 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.428 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 63.43 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.420000000000002 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.488 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.010000000000005 110.874 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.76 0.314 . . . . 75.299999999999997 110.804 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.435 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.823 HG21 HD11 ' A' ' 136' ' ' LEU . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 63.109999999999999 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.109999999999999 110.874 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 71.510000000000005 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.788 HD11 ' CD1' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.319999999999993 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.828 ' HB3' HG13 ' A' ' 129' ' ' VAL . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 74.510000000000005 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.474 ' HA ' HG13 ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.439999999999998 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.775 ' CE1' HD13 ' A' ' 20' ' ' ILE . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 64.340000000000003 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.839 HG22 ' SD ' ' A' ' 101' ' ' MET . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.430000000000007 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.200000000000003 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.129999999999995 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.632 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 25.440000000000001 111.131 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.908 0.385 . . . . 74.329999999999998 110.822 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.340000000000003 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 42' ' ' LEU . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.140000000000001 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.209999999999994 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.981 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.010000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.085 HD23 HG12 ' A' ' 91' ' ' VAL . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 62.219999999999999 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.120000000000005 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.549999999999997 110.803 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.651 HG23 ' N ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 60.130000000000003 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.651 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.319999999999993 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 63.210000000000001 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.514 HD13 ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 4.3 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 70.109999999999999 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.439999999999998 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.497 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.519999999999996 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 90.3 m-70 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.340000000000003 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 74.319999999999993 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 62.200000000000003 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.329999999999998 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.109999999999999 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 35.409999999999997 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 60.149999999999999 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 50.030000000000001 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.219999999999999 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.787 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.349999999999994 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.200000000000003 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 61.43 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.915 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.420000000000002 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 72.209999999999994 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.726 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.019999999999996 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.866 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 71.030000000000001 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.85 ' HG3' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 72.140000000000001 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.919 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 62.119999999999997 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 60.140000000000001 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.911 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.607 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 72.109999999999999 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.446 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.788 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.240000000000002 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.725 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.409999999999997 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.513 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 44.210000000000001 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.788 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 1.085 HG12 HD23 ' A' ' 42' ' ' LEU . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 72.310000000000002 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.020000000000003 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 42' ' ' LEU . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.049999999999997 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.958 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 53.149999999999999 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.859 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 61.140000000000001 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.818 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.109999999999999 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.958 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 72.540000000000006 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.839 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.120000000000005 110.854 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG2' ' CE1' ' A' ' 21' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.878 0.37 . . . . 75.230000000000004 111.167 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.573 ' N ' HG23 ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.109999999999999 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.310000000000002 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.815 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 71.049999999999997 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.129999999999995 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.915 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 54.439999999999998 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.828 HG13 ' HB3' ' A' ' 16' ' ' LEU . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 53.130000000000003 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.917 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.859 HD21 ' HB2' ' A' ' 97' ' ' ALA . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.439999999999998 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.635 ' O ' HD13 ' A' ' 136' ' ' LEU . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.450000000000003 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.109999999999999 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.866 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.972 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.885 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.519999999999996 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.439999999999998 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 35.7 m-70 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.140000000000001 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.549999999999997 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.239999999999995 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.843 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 71.430000000000007 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.726 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.725 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.219999999999999 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 40.439999999999998 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.120000000000005 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.209999999999994 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.430000000000007 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.109999999999999 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.61 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 61.119999999999997 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.829 ' HA ' HD23 ' A' ' 41' ' ' LEU . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 62.509999999999998 110.887 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.57 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 64.040000000000006 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.467 ' CB ' HD11 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.030000000000001 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 65.319999999999993 110.917 179.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.981 ' HA ' HD22 ' A' ' 41' ' ' LEU . 4.5 t30 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 60.210000000000001 110.878 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.79 0.328 . . . . 71.140000000000001 110.84 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.592 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 71.439999999999998 110.951 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.73 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.239999999999995 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.863 HD11 HD11 ' A' ' 94' ' ' LEU . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 54.229999999999997 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.120000000000005 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 64.319999999999993 110.896 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 71.109999999999999 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.803 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.299999999999997 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.420000000000002 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.644 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 70.219999999999999 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.109999999999999 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.694 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 51.439999999999998 111.103 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.895 0.378 . . . . 43.119999999999997 110.816 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 64.340000000000003 111.06 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.73 ' CG ' HD22 ' A' ' 15' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 64.439999999999998 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.120000000000005 111.102 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 55.43 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.350000000000001 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 63.329999999999998 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 65.129999999999995 110.819 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.400000000000006 110.844 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.678 HG23 ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 54.310000000000002 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.439999999999998 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.543 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.540000000000006 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.340000000000003 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.584 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.4 m-70 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.209999999999994 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.200000000000003 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 61.210000000000001 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 54.219999999999999 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 50.340000000000003 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 1.072 ' CD1' HD21 ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 70.150000000000006 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 61.200000000000003 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.150000000000006 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.693 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.019999999999996 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.329999999999998 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.439999999999998 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 1.072 HD21 ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 54.420000000000002 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.985 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 60.420000000000002 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.615 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.219999999999999 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.906 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.019999999999996 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.91 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.91 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.200000000000003 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.399999999999999 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.299999999999997 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.759 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 55.140000000000001 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 71.519999999999996 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.799 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.019999999999996 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 70.019999999999996 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 1.087 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.420000000000002 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.400000000000006 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.087 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.239999999999995 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 72.109999999999999 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.56 ' HG2' HG21 ' A' ' 49' ' ' ILE . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.25 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.56 ' CD2' HD11 ' A' ' 78' ' ' LEU . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 63.43 110.94 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 73.200000000000003 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.565 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.996 ' CE2' HD11 ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.129999999999995 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 63.049999999999997 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.329999999999998 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.671 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 51.43 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.996 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.803 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 70.299999999999997 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.961 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.875 0.369 . . . . 71.219999999999999 111.152 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 61.219999999999999 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.519999999999996 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 1.012 ' O ' HG12 ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.409999999999997 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 63.009999999999998 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 123' ' ' ARG . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.885 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.985 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.200000000000003 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 1.012 HG12 ' O ' ' A' ' 125' ' ' CYS . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.120000000000005 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 72.109999999999999 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.209999999999994 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.606 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 62.130000000000003 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 65.409999999999997 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.624 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 55.030000000000001 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.606 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 64.409999999999997 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 53.420000000000002 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.329999999999998 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.120000000000005 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.9 m-70 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.140000000000001 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 62.200000000000003 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.329999999999998 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.219999999999999 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.691 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.019999999999996 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 72.209999999999994 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 70.319999999999993 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 72.140000000000001 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 62.420000000000002 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 72.549999999999997 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.718 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 65.430000000000007 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.688 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.340000000000003 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.642 ' CD2' HG11 ' A' ' 45' ' ' VAL . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.450000000000003 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 55.310000000000002 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.68 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.530000000000001 110.846 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 3.1 pt-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.887 0.375 . . . . 73.349999999999994 110.939 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.540000000000006 110.873 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.954 ' CG2' HD21 ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 72.299999999999997 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 64.530000000000001 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 70.239999999999995 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.521 ' HA ' HG21 ' A' ' 129' ' ' VAL . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 64.329999999999998 110.845 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.732 ' CE1' HG21 ' A' ' 46' ' ' THR . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.530000000000001 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.66 HG21 ' CB ' ' A' ' 125' ' ' CYS . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 64.439999999999998 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.429 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 64.239999999999995 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.549999999999997 111.075 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.903 0.382 . . . . 61.149999999999999 110.82 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.632 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 73.030000000000001 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.776 ' HB2' HD22 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.299999999999997 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.140000000000001 111.068 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 63.409999999999997 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.835 HD21 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 53.310000000000002 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 62.140000000000001 110.947 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.540000000000006 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.8 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.732 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.430000000000007 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 71.329999999999998 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.642 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 71.129999999999995 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.642 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.109999999999999 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.019999999999996 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.120000000000005 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.2 m-70 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.140000000000001 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 60.439999999999998 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.239999999999995 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 62.140000000000001 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.039999999999999 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 73.219999999999999 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.442 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.239999999999995 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 70.150000000000006 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.450000000000003 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.826 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.129999999999995 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.856 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.510000000000005 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.986 HD12 HD13 ' A' ' 127' ' ' LEU . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.450000000000003 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.040000000000006 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.826 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 61.310000000000002 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.964 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 64.150000000000006 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.52 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.120000000000005 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.772 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 70.439999999999998 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 62.43 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.530000000000001 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.86 ' HG3' HD23 ' A' ' 78' ' ' LEU . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 65.310000000000002 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 73.430000000000007 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.48 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 72.239999999999995 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.412 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.299999999999997 110.874 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.605 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.519999999999996 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.310000000000002 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.819 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 65.349999999999994 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.409999999999997 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.711 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.499 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.329999999999998 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.819 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 65.349999999999994 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 64.219999999999999 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.837 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.239999999999995 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.835 HD23 HD21 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 42.140000000000001 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.697 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.219999999999999 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.944 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 70.310000000000002 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 54.299999999999997 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.130000000000003 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.340000000000003 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.944 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.140000000000001 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.566 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 73.230000000000004 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.420000000000002 110.926 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.903 0.382 . . . . 62.229999999999997 111.124 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.425 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.400000000000006 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.425 ' N ' HG23 ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.010000000000005 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.566 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.030000000000001 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.66 ' CB ' HG21 ' A' ' 20' ' ' ILE . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 51.329999999999998 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 55.420000000000002 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.986 HD13 HD12 ' A' ' 68' ' ' LEU . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.964 ' CG1' HG21 ' A' ' 71' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.510000000000005 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.643 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.329999999999998 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.976 ' CD1' ' HB2' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.409999999999997 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.592 HD22 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.129999999999995 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.818 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 65.230000000000004 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.954 HD21 ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.200000000000003 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.519 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.439999999999998 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.48 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 61.439999999999998 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.491 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 64.430000000000007 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 34.530000000000001 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.828 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.409999999999997 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.703 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.430000000000007 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 62.229999999999997 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.711 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 54.43 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.329999999999998 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.310000000000002 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 61.329999999999998 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.632 ' SG ' HG12 ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.200000000000003 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.329999999999998 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.420000000000002 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.944 ' HB2' HD11 ' A' ' 41' ' ' LEU . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.349999999999994 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.487 ' HB2' ' CD2' ' A' ' 41' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 62.409999999999997 110.899 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.815 0.34 . . . . 74.299999999999997 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.239999999999995 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.785 HG21 HD11 ' A' ' 136' ' ' LEU . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.510000000000005 111.161 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 54.509999999999998 110.909 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.539 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.030000000000001 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.409999999999997 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.97 ' HB3' HG13 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 64.540000000000006 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 64.329999999999998 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.563 ' OD2' ' HB1' ' A' ' 39' ' ' ALA . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.400000000000006 110.954 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.691 ' CZ ' HD12 ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.340000000000003 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.695 HD13 HG22 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.530000000000001 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.565 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 62.530000000000001 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 71.129999999999995 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.565 ' HB2' ' CG ' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.129999999999995 111.088 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.956 0.407 . . . . 71.310000000000002 110.811 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.447 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.040000000000006 111.156 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.563 ' HB1' ' OD2' ' A' ' 18' ' ' ASP . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 62.039999999999999 111.072 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.62 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 70.239999999999995 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.99 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 61.200000000000003 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 63.299999999999997 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 65.019999999999996 110.862 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.746 HG11 ' CD2' ' A' ' 158' ' ' PHE . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.671 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.646 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 63.140000000000001 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.646 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.5 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.140000000000001 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.319999999999993 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.577 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 61.049999999999997 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.3 m-70 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.140000000000001 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.239999999999995 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 64.299999999999997 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 63.140000000000001 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.450000000000003 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.239999999999995 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.0 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.414 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.888 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.428 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 51.340000000000003 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.530000000000001 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.77 ' O ' HD13 ' A' ' 100' ' ' LEU . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 71.540000000000006 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.674 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.040000000000006 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.95 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 63.509999999999998 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 71.299999999999997 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.219999999999999 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.782 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 63.210000000000001 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.784 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 61.310000000000002 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.049999999999997 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.923 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.129999999999995 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.923 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 73.439999999999998 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.897 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.530000000000001 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.402 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.837 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.471 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 61.020000000000003 110.938 179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.430000000000007 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.019999999999996 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.230000000000004 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.140000000000001 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 61.210000000000001 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.965 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.140000000000001 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 64.540000000000006 110.834 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.528 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.430000000000007 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.965 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.140000000000001 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.704 HG12 HD11 ' A' ' 42' ' ' LEU . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 53.049999999999997 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.589 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.99 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 61.439999999999998 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.924 ' CE2' HD11 ' A' ' 100' ' ' LEU . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.039999999999999 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.340000000000003 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.030000000000001 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.924 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 55.119999999999997 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.565 ' CG ' ' HB2' ' A' ' 24' ' ' ALA . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.538 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.230000000000004 110.819 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.899 0.38 . . . . 62.420000000000002 111.09 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.454 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.150000000000006 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' HG23 ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.099999999999994 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.49 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.329999999999998 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.682 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 55.439999999999998 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.95 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.97 HG13 ' HB3' ' A' ' 16' ' ' LEU . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 62.140000000000001 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.582 HD22 ' N ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.519999999999996 110.888 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.955 HD21 ' HB2' ' A' ' 97' ' ' ALA . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.530000000000001 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 63.219999999999999 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.784 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.962 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.959 ' N ' HD13 ' A' ' 136' ' ' LEU . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 65.319999999999993 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.310000000000002 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 52.420000000000002 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.471 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 71.219999999999999 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 40.1 m-70 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 64.549999999999997 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.464 ' C ' ' HD3' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 70.140000000000001 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 72.219999999999999 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.519999999999996 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 63.140000000000001 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.72 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 53.299999999999997 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.540000000000006 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 71.030000000000001 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.439999999999998 110.923 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.439999999999998 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.420000000000002 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.702 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.299999999999997 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.528 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.140000000000001 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.55 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.548 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 62.240000000000002 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.746 ' CD2' HG11 ' A' ' 45' ' ' VAL . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.430000000000007 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.329999999999998 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.585 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 61.100000000000001 110.846 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.783 0.325 . . . . 71.299999999999997 110.84 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.966 HG21 HD11 ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.430000000000007 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 71.409999999999997 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 71.430000000000007 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.749 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 54.109999999999999 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 64.510000000000005 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 52.25 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.666 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 61.030000000000001 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.947 HG23 ' HG3' ' A' ' 101' ' ' MET . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 72.040000000000006 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.219999999999999 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.310000000000002 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 63.219999999999999 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 53.130000000000003 111.066 -179.984 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.91 0.386 . . . . 51.310000000000002 110.861 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.738 ' CG ' HD22 ' A' ' 15' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.129999999999995 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.310000000000002 111.143 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.659 ' HB3' HD21 ' A' ' 160' ' ' ASN . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 64.519999999999996 111.084 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.752 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.520000000000003 110.903 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.219999999999999 110.84 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.785 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.716 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.209999999999994 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.589 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 73.129999999999995 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.589 HD13 ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.439999999999998 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 60.539999999999999 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.120000000000005 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.149999999999999 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.510000000000005 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.329999999999998 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 70.030000000000001 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.430000000000007 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.578 ' HE1' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 41.299999999999997 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 55.439999999999998 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 61.310000000000002 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.129999999999995 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.209999999999994 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.723 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.430000000000007 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.642 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 62.299999999999997 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.510000000000005 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.723 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 72.420000000000002 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.782 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 71.450000000000003 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.239999999999995 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.744 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.109999999999999 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.893 ' HG2' HD23 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 65.230000000000004 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.893 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.469 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 70.099999999999994 110.877 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.030000000000001 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.583 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 64.040000000000006 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.815 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.020000000000003 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 1.034 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 70.549999999999997 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.549 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 73.319999999999993 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.034 HD12 ' CE3' ' A' ' 87' ' ' TRP . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.140000000000001 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.725 HG11 ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.109999999999999 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.453 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.842 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 63.420000000000002 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 51.109999999999999 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.716 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 52.109999999999999 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.898 ' CE2' HD21 ' A' ' 100' ' ' LEU . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 54.049999999999997 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.431 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.120000000000005 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.109999999999999 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.995 HD12 HD11 ' A' ' 128' ' ' ILE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.947 ' HG3' HG23 ' A' ' 20' ' ' ILE . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 44.329999999999998 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.319999999999993 110.911 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.933 0.397 . . . . 61.299999999999997 111.147 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.461 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 62.229999999999997 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.461 ' N ' HG23 ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.430000000000007 110.912 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.725 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.209999999999994 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.299999999999997 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 54.130000000000003 110.951 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.995 HD11 HD12 ' A' ' 100' ' ' LEU . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.349999999999994 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 125' ' ' CYS . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.010000000000005 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.791 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 71.120000000000005 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.426 HD22 ' N ' ' A' ' 134' ' ' ASN . 1.0 OUTLIER -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 132' ' ' LEU . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 64.409999999999997 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.966 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.871 ' N ' HD13 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.129999999999995 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.310000000000002 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.030000000000001 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 60.439999999999998 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.140000000000001 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.423 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 62.039999999999999 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.129999999999995 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.721 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 62.219999999999999 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 63.520000000000003 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 73.140000000000001 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 52.340000000000003 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.430000000000007 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.420000000000002 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.010000000000005 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 71.340000000000003 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.725 ' CE1' HG11 ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 70.049999999999997 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 55.530000000000001 110.914 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.56 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 64.420000000000002 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 62.219999999999999 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.785 ' CD2' HG11 ' A' ' 45' ' ' VAL . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 65.439999999999998 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.455 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 63.439999999999998 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.697 ' HA ' HD22 ' A' ' 41' ' ' LEU . 16.5 t-20 . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.230000000000004 110.885 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.827 0.346 . . . . 60.450000000000003 110.891 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.811 HG21 HD21 ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 62.32 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.540000000000006 110.902 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 63.039999999999999 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.753 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.230000000000004 110.937 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 42.140000000000001 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.540000000000006 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.731 ' CE1' HG21 ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 53.509999999999998 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.55 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 72.230000000000004 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 74.120000000000005 110.906 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 40.520000000000003 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 50.32 111.09 179.975 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.927 0.394 . . . . 51.439999999999998 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 37' ' ' VAL . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.109999999999999 111.154 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 15' ' ' LEU . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 62.119999999999997 110.915 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.152 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HB1' HD21 ' A' ' 160' ' ' ASN . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.239999999999995 111.139 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.896 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.420000000000002 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.075 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 65.129999999999995 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.457 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.726 HG11 ' CD2' ' A' ' 158' ' ' PHE . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 65.200000000000003 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.731 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 62.409999999999997 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.099999999999994 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.577 HG21 ' HG2' ' A' ' 92' ' ' MET . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.340000000000003 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 51.100000000000001 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.583 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.612 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.0 m-70 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.549999999999997 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.430000000000007 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.130000000000003 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.409999999999997 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.612 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.150000000000006 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.129999999999995 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.140000000000001 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.120000000000005 110.859 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.400000000000006 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.420000000000002 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.120000000000005 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.409999999999997 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.896 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.409999999999997 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.812 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 31.239999999999998 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.557 HD13 HD13 ' A' ' 127' ' ' LEU . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.896 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.987 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 62.130000000000003 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 61.509999999999998 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.721 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.109999999999999 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.588 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 71.200000000000003 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.918 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.420000000000002 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.918 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.439999999999998 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.867 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.019999999999996 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.465 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.420000000000002 110.816 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.430000000000007 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 71.340000000000003 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.621 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 50.299999999999997 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 65.299999999999997 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.816 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.040000000000006 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.299999999999997 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.993 ' CE3' HD12 ' A' ' 90' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.430000000000007 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.239999999999995 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.993 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.819 HG12 HD23 ' A' ' 42' ' ' LEU . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 62.549999999999997 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.577 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.574 HD11 ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 40.420000000000002 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.075 HD23 HD13 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.230000000000004 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 62.210000000000001 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.987 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.120000000000005 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.845 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.209999999999994 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.511 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.420000000000002 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.677 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 65.310000000000002 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.987 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.210000000000001 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 20' ' ' ILE . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.510000000000005 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.010000000000005 110.903 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.887 0.375 . . . . 74.439999999999998 111.093 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.442 HG23 ' N ' ' A' ' 123' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 71.140000000000001 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.409999999999997 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.531 ' HA ' HD21 ' A' ' 127' ' ' LEU . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.724 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 64.530000000000001 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.219999999999999 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.998 HD12 ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 73.329999999999998 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.998 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.040000000000006 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 16' ' ' LEU . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.510000000000005 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.319999999999993 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 61.25 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.845 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.120000000000005 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.48 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 71.129999999999995 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.588 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 71.129999999999995 110.896 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.811 HD21 HG21 ' A' ' 12' ' ' THR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 65.349999999999994 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.200000000000003 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.130000000000003 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.55 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 60.200000000000003 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 71.319999999999993 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.718 ' NE2' HD12 ' A' ' 79' ' ' LEU . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 64.420000000000002 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.583 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.299999999999997 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.55 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 44.43 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 63.329999999999998 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.903 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 55.450000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.903 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.340000000000003 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 34.020000000000003 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.099999999999994 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.408 ' C ' ' O ' ' A' ' 150' ' ' GLY . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.510000000000005 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.448 ' C ' ' OD1' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.340000000000003 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 61.509999999999998 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.723 ' CE1' HG11 ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.430000000000007 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.896 ' HA ' HD23 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 62.100000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.567 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.219999999999999 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.340000000000003 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.726 ' CD2' HG11 ' A' ' 45' ' ' VAL . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 62.020000000000003 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.611 ' CA ' HD22 ' A' ' 41' ' ' LEU . 1.9 t30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 61.130000000000003 110.868 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.0 tm-20 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.874 0.369 . . . . 74.439999999999998 110.882 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.436 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.400000000000006 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.551 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 110.909 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.540000000000006 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.129999999999995 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB3' HG23 ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.129999999999995 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.450000000000003 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.728 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.652 HG21 ' HA ' ' A' ' 125' ' ' CYS . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.400000000000006 110.907 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.651 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 111.092 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.891 0.377 . . . . 44.32 110.844 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.119999999999997 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 62.310000000000002 111.065 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.219999999999999 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.952 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.130000000000003 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.946 HD22 HD12 ' A' ' 94' ' ' LEU . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.019999999999996 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 54.210000000000001 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.530000000000001 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.648 HG23 ' N ' ' A' ' 46' ' ' THR . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 63.020000000000003 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.728 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 53.200000000000003 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 61.130000000000003 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.540000000000006 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.53 HD13 ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.099999999999994 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.219999999999999 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 73.019999999999996 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.6 m-70 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 70.310000000000002 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 54.409999999999997 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.608 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.549999999999997 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 34.149999999999999 110.863 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.120000000000005 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.340000000000003 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.319999999999993 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.310000000000002 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.937 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.120000000000005 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.709 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 65.010000000000005 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.049999999999997 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 64.120000000000005 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.937 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.519999999999996 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 1.004 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 61.020000000000003 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.299999999999997 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.655 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 72.099999999999994 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.507 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.349999999999994 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.319999999999993 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.756 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 71.519999999999996 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.310000000000002 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.430000000000007 110.925 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.540000000000006 110.901 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.507 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.539999999999999 110.905 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.582 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 61.25 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.100000000000001 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.812 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 63.409999999999997 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 63.32 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.889 ' HA ' HD23 ' A' ' 93' ' ' LEU . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.109999999999999 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.79 HG12 HD23 ' A' ' 42' ' ' LEU . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 61.32 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.435 ' HG2' HG21 ' A' ' 49' ' ' ILE . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.519999999999996 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.946 HD12 HD22 ' A' ' 42' ' ' LEU . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.329999999999998 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.535 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 63.229999999999997 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 1.023 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.109999999999999 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.47 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.129999999999995 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.209999999999994 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.023 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 72.439999999999998 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.651 ' HG2' ' HB2' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.481 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 71.129999999999995 110.918 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.497 HG13 ' N ' ' A' ' 122' ' ' THR . 5.8 p . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 70.150000000000006 111.146 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.497 ' N ' HG13 ' A' ' 121' ' ' VAL . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 54.119999999999997 111.086 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.837 ' O ' HD13 ' A' ' 127' ' ' LEU . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.349999999999994 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.904 ' O ' HG12 ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 53.329999999999998 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.150000000000006 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 1.004 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.109999999999999 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.904 HG12 ' O ' ' A' ' 125' ' ' CYS . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 73.010000000000005 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 62.109999999999999 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.420000000000002 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.209999999999994 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.598 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.209999999999994 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.611 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 63.039999999999999 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.861 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.598 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.209999999999994 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.585 ' HA3' ' CD2' ' A' ' 141' ' ' HIS . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.040000000000006 112.504 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 110.863 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.422 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.209999999999994 110.942 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.611 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.492 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.540000000000006 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.239999999999995 111.152 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.120000000000005 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 62.009999999999998 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.765 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.329999999999998 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.109999999999999 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 44.5 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.340000000000003 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . 0.429 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 44.43 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.615 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 72.540000000000006 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.761 ' HA ' HD23 ' A' ' 41' ' ' LEU . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.420000000000002 110.859 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.564 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 53.509999999999998 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 62.439999999999998 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.577 ' CD2' HG11 ' A' ' 45' ' ' VAL . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.340000000000003 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.952 ' HA ' HD22 ' A' ' 41' ' ' LEU . 3.8 t30 . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 60.210000000000001 110.923 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.885 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' NH2' ' NH2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.140000000000001 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.959 HG21 HD11 ' A' ' 136' ' ' LEU . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.530000000000001 111.099 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.099999999999994 110.899 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.040000000000006 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.739 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 55.130000000000003 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 94' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 64.510000000000005 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.229999999999997 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 52.049999999999997 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.55 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.120000000000005 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.934 HG23 ' HG3' ' A' ' 101' ' ' MET . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 55.329999999999998 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.310000000000002 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.409999999999997 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 65.140000000000001 111.115 -179.996 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.882 0.372 . . . . 74.439999999999998 110.921 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.418 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.230000000000004 111.154 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.731 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 55.140000000000001 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 40.329999999999998 111.135 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.67 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 72.230000000000004 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.866 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 65.099999999999994 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.010000000000005 110.848 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.751 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 72.329999999999998 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 62.109999999999999 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.7 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 55.149999999999999 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.7 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 65.319999999999993 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.109999999999999 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.219999999999999 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.584 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.219999999999999 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.2 m-70 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.230000000000004 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 70.150000000000006 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 72.430000000000007 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.340000000000003 110.882 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 55.340000000000003 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.200000000000003 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 45.229999999999997 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.530000000000001 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.443 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 64.439999999999998 110.803 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.120000000000005 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 73.329999999999998 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.756 ' O ' HD13 ' A' ' 100' ' ' LEU . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 64.200000000000003 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 51.340000000000003 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.219999999999999 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.568 HD21 ' CE1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.953 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 41.420000000000002 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 72.219999999999999 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.672 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.219999999999999 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.82 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.009999999999998 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.91 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 60.399999999999999 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.91 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 55.310000000000002 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.802 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.030000000000001 110.851 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.482 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 61.229999999999997 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.609 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 70.219999999999999 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.319999999999993 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.828 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.349999999999994 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 1.052 ' CE3' HD12 ' A' ' 90' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.200000000000003 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 92' ' ' MET . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.209999999999994 110.874 -179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.230000000000004 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.052 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 53.219999999999999 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.721 HG11 ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.019999999999996 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.548 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 53.009999999999998 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 75' ' ' ALA . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 62.119999999999997 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 16' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 55.229999999999997 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.725 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 111.142 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.979 ' CE2' HD11 ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 71.409999999999997 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.409999999999997 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 63.530000000000001 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.616 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.310000000000002 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.979 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 54.310000000000002 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.934 ' HG3' HG23 ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.554 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.916 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 125' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.889 0.376 . . . . 74.049999999999997 111.105 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.25 111.153 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . 0.725 ' O ' HD23 ' A' ' 127' ' ' LEU . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . 0.766 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.953 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.450000000000003 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 125' ' ' CYS . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.329999999999998 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 73.230000000000004 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.140000000000001 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 55.109999999999999 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 70.319999999999993 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.82 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.430000000000007 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.003 HD13 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.340000000000003 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 1.003 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 71.209999999999994 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.009999999999998 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 52.140000000000001 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.482 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.219999999999999 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.473 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 62.439999999999998 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.854 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 65.099999999999994 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.854 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 65.329999999999998 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.010000000000005 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 71.340000000000003 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.319999999999993 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' GLY . . . . . 0.493 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.109999999999999 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.230000000000004 110.951 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.310000000000002 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 33.340000000000003 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.721 ' CE1' HG11 ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.409999999999997 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 156' ' ' ARG . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.450000000000003 110.915 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' PHE . . . . . 0.751 ' CD2' HG11 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 71.420000000000002 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ASN . . . . . 0.53 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.5 t30 . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 71.530000000000001 110.846 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.57 0 N-CA-C 110.273 -1.131 . . . . 65.140000000000001 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -20.41 35.0 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.65 2.233 . . . . 71.129999999999995 112.374 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -114.07 -177.37 3.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 70.230000000000004 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.13 119.94 2.97 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.689 -0.767 . . . . 62.43 112.533 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 23.8 t -167.63 156.8 9.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 70.409999999999997 110.861 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -18.03 30.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 72.299999999999997 110.834 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.95 148.85 24.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 63.399999999999999 111.139 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.11 -66.75 0.9 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.322 -0.399 . . . . 50.240000000000002 110.859 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 t -104.08 -20.96 13.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 63.520000000000003 110.923 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -89.42 44.12 1.19 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.156 -0.475 . . . . 72.099999999999994 110.86 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HB2' ' CB ' ' A' ' 9' ' ' HIS . 4.0 p30 -57.6 143.82 74.37 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.633 0.73 . . . . 75.310000000000002 110.864 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -91.0 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.696 2.264 . . . . 54.32 112.357 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 9' ' ' HIS . 7.6 mp -100.05 -5.15 28.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.428 ' CD2' ' OH ' ' A' ' 133' ' ' TYR . 20.2 t-80 -36.61 -71.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 73.349999999999994 110.868 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.408 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 30.8 tt0 -74.04 -8.31 55.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 75.230000000000004 110.926 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.416 ' CB ' ' HA ' ' A' ' 8' ' ' LEU . 10.2 tpp85 -74.86 -42.35 58.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 63.340000000000003 110.854 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.944 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -79.65 -42.78 24.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.469 . . . . 72.329999999999998 111.147 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 3.8 tpt180 -58.3 -50.68 72.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 73.420000000000002 110.906 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.517 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.74 -41.24 98.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 74.230000000000004 110.882 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.023 HD13 ' OE1' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -63.52 -47.12 82.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.914 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.6 mp -61.71 -50.89 70.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.946 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.8 m -61.74 -32.87 73.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 35.229999999999997 110.908 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.25 -35.3 79.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.501 . . . . 51.240000000000002 110.834 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.716 ' CE1' HG21 ' A' ' 46' ' ' THR . 85.2 t80 -69.09 -40.52 78.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 73.150000000000006 110.905 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.537 HG13 ' CG2' ' A' ' 129' ' ' VAL . 4.7 mm -54.96 -49.04 74.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 63.409999999999997 111.098 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -61.5 -41.68 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.876 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CE1' ' HG2' ' A' ' 32' ' ' PRO . 6.3 m-30 -63.08 -36.18 82.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.7 t -70.65 -44.03 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 72.319999999999993 110.823 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -70.85 -8.95 56.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 61.119999999999997 111.118 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' CD ' ' HB3' ' A' ' 31' ' ' GLU . 34.2 ptt-85 -34.0 115.55 0.24 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 63.240000000000002 110.899 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.587 ' HB2' HG22 ' A' ' 29' ' ' THR . 3.3 mt-10 -38.91 143.6 0.46 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.699 0.761 . . . . 74.109999999999999 110.814 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -4.69 14.55 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.317 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.66 6.76 14.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.231 -0.44 . . . . 74.519999999999996 110.856 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.2 t -150.89 127.9 5.43 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 53.420000000000002 111.101 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 150.37 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.717 2.278 . . . . 70.439999999999998 112.339 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HB3' ' CD ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.33 153.63 71.52 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.633 0.73 . . . . 72.219999999999999 110.888 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 53.9 Cg_endo -69.82 170.17 17.26 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 63.109999999999999 112.326 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 170.72 15.91 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.62 2.213 . . . . 71.430000000000007 112.363 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 169.5 18.68 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.626 2.218 . . . . 73.400000000000006 112.402 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.431 HG21 ' NH2' ' A' ' 14' ' ' ARG . 1.4 m -106.72 -36.93 6.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.234 -0.439 . . . . 73.409999999999997 111.053 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.63 175.99 9.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 71.010000000000005 110.834 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.8 -46.8 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 64.099999999999994 111.096 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 1.023 ' OE1' HD13 ' A' ' 15' ' ' LEU . 1.3 pp20? -60.65 -34.16 73.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 73.319999999999993 110.817 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.655 ' N ' ' OE1' ' A' ' 38' ' ' GLU . . . -71.9 -34.39 69.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 62.25 111.118 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' HB1' HD23 ' A' ' 162' ' ' LEU . . . -74.71 -52.76 10.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 111.109 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.901 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.5 -52.24 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.472 . . . . 72.230000000000004 110.96 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.136 HD13 HD23 ' A' ' 94' ' ' LEU . 74.1 mt -50.77 -44.47 58.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 75.430000000000007 110.902 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.466 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.95 -24.92 67.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.520000000000003 110.871 179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.441 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -86.48 -38.56 17.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 61.219999999999999 110.825 -179.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.698 HG13 HD22 ' A' ' 41' ' ' LEU . 1.1 m -91.72 -50.78 12.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 111.139 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.728 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.7 OUTLIER -55.93 -32.73 64.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.176 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HD2' ' N ' ' A' ' 48' ' ' GLN . 0.3 OUTLIER -59.94 -34.32 73.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 71.209999999999994 110.829 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.497 ' NE2' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -78.73 -29.94 45.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 74.519999999999996 110.928 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 19.5 mm -62.78 -32.1 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.299999999999997 111.134 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -81.04 -61.07 2.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 110.918 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.08 -19.47 0.27 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 70.329999999999998 110.901 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.509 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.77 -42.05 8.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.908 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 75.8 m-70 -103.45 -43.79 5.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 70.319999999999993 110.867 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.31 -23.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.46 . . . . 71.450000000000003 110.966 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.2 -32.8 3.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.257 -0.429 . . . . 74.230000000000004 110.881 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.407 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 5.4 m-85 -103.4 -37.87 7.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.030000000000001 110.9 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.2 m-30 -53.89 -53.28 54.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.239999999999995 110.881 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.3 t -49.94 -45.09 50.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 72.319999999999993 110.842 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.1 t -51.88 -40.27 60.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 73.349999999999994 110.851 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.4 m-85 -76.09 -39.29 55.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 74.400000000000006 110.852 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -47.98 -29.97 3.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 35.219999999999999 110.92 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -122.16 33.35 5.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.329999999999998 110.873 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 44.5 t -114.09 -68.35 0.93 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 61.119999999999997 110.89 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.482 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.8 mmt180 -99.71 -13.69 19.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 74.140000000000001 110.952 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.03 2.96 67.13 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.836 -0.697 . . . . 75.409999999999997 112.51 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.58 31.0 0.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.779 0.323 . . . . 71.140000000000001 110.897 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.71 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.92 -34.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.842 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -78.69 -51.24 10.12 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 63.420000000000002 110.943 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.512 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 17.0 mm-40 -50.36 -32.27 16.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.462 . . . . 53.210000000000001 110.87 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.607 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -79.68 -36.82 37.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 54.340000000000003 110.884 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.719 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.04 -45.19 95.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 61.240000000000002 111.154 179.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.2 ptpt -72.61 -43.65 63.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 110.861 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -49.65 70.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 64.340000000000003 110.899 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.649 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 14.7 mmm -58.02 -54.95 41.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 72.239999999999995 110.898 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.74 -21.55 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 70.0 111.073 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -83.42 -30.1 27.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 51.310000000000002 110.869 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.5 ptpt -80.12 -48.48 13.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.465 . . . . 73.0 110.898 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.99 -59.76 2.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.202 -0.454 . . . . 72.439999999999998 110.99 179.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -87.08 156.74 19.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.936 179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.578 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -160.09 -175.58 5.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 110.912 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.47 ' O ' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.99 -45.06 5.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 64.109999999999999 110.871 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.465 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -96.17 11.59 33.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 63.509999999999998 110.888 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 83' ' ' GLN . 0.4 OUTLIER -111.48 132.57 54.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 74.129999999999995 110.898 -179.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -73.94 74.39 1.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 44.109999999999999 110.815 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.883 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.34 173.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 71.430000000000007 110.919 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 t -134.97 156.33 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 71.430000000000007 110.908 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.683 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.8 m95 -48.95 -39.69 27.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.924 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -60.59 -31.36 70.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.229 -0.441 . . . . 61.210000000000001 110.909 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.6 mm100 -74.98 -37.82 61.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 75.120000000000005 110.879 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.883 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.9 mm? -60.34 -55.98 27.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 71.120000000000005 110.923 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.849 HG12 ' CD2' ' A' ' 42' ' ' LEU . 23.5 m -60.94 -31.9 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 65.040000000000006 111.116 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.422 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.2 tmm? -62.26 -44.69 95.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 62.350000000000001 110.838 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 93' ' ' LEU . 6.8 mt -57.93 -45.46 86.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 74.230000000000004 110.893 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.136 HD23 HD13 ' A' ' 42' ' ' LEU . 0.8 OUTLIER -59.28 -49.36 78.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.471 . . . . 74.010000000000005 110.982 179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.728 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.66 -56.86 16.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 75.340000000000003 111.116 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.914 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.6 t80 -54.08 -60.5 3.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.221 -0.445 . . . . 75.319999999999993 110.862 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.5 -56.32 0.81 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 71.120000000000005 111.018 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.37 -29.45 75.28 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.74 -0.743 . . . . 52.439999999999998 112.48 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -66.54 -27.19 67.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.903 0.382 . . . . 52.340000000000003 111.126 -179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.914 HD21 ' CE2' ' A' ' 96' ' ' PHE . 3.9 mt -79.74 -32.5 41.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 65.120000000000005 110.938 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 13.6 tpp -35.68 105.34 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 72.239999999999995 110.858 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -96.51 161.58 13.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 44.020000000000003 110.921 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.443 ' OE1' ' C ' ' A' ' 102' ' ' ASN . 6.8 mp0 -128.56 161.53 29.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 62.539999999999999 110.853 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.547 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -161.22 46.71 0.38 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 41.32 112.546 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.3 Cg_endo -69.69 -162.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.709 2.273 . . . . 72.109999999999999 112.363 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.505 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.19 -70.89 0.74 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 74.340000000000003 110.905 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.636 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.91 72.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 73.040000000000006 110.93 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' A' ' 109' ' ' VAL . . . -62.3 -23.45 66.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 71.120000000000005 111.048 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.498 HG13 ' N ' ' A' ' 110' ' ' LYS . 4.0 p -31.29 -45.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 73.219999999999999 111.13 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.498 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.5 mttm -90.56 82.59 5.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 74.349999999999994 110.882 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 108' ' ' ALA . 0.0 OUTLIER -88.74 95.06 10.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 71.549999999999997 110.868 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 24.3 ttmt -69.84 -48.23 59.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.262 -0.426 . . . . 51.130000000000003 110.884 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.15 -162.15 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 74.109999999999999 110.857 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -94.38 -4.11 49.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 65.219999999999999 110.853 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.58 3.37 47.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 70.420000000000002 110.861 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -63.46 99.31 0.28 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.734 -0.746 . . . . 75.549999999999997 112.507 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -178.39 146.49 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 63.32 110.928 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.674 ' HB3' HG23 ' A' ' 120' ' ' ILE . 5.9 mmm180 -65.71 167.77 8.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 64.420000000000002 110.889 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.493 ' O ' HG22 ' A' ' 122' ' ' THR . 35.2 m -75.6 -12.47 14.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 73.049999999999997 111.129 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.904 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -53.41 -29.87 17.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 64.340000000000003 111.139 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.904 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -70.64 -47.73 62.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.467 . . . . 74.109999999999999 111.161 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 119' ' ' VAL . 2.4 t -67.06 -40.63 87.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.126 -0.488 . . . . 65.319999999999993 111.167 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.542 ' O ' HD22 ' A' ' 127' ' ' LEU . 4.9 ptm180 -67.86 -51.1 52.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 61.539999999999999 110.894 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 20.5 t70 -70.56 -26.76 63.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 74.200000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.611 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.5 t -67.43 -35.5 79.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 71.010000000000005 110.87 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.486 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 45.8 t -71.86 -43.57 65.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.349999999999994 110.913 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.542 HD22 ' O ' ' A' ' 123' ' ' ARG . 1.2 mm? -75.36 -54.16 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 71.230000000000004 110.946 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.719 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.5 tt -54.45 -47.67 70.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.13 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.9 t -72.82 -33.23 43.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.161 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.486 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.1 t-20 -59.23 -36.15 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.871 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.0 t80 -71.5 -55.37 7.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 73.239999999999995 110.859 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 97' ' ' ALA . 7.4 mt -63.27 -54.63 34.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.147 -0.479 . . . . 61.32 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 23.7 t80 -43.63 -51.26 7.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 75.349999999999994 110.94 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -71.38 -31.37 67.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 51.43 110.918 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.556 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.91 -46.03 85.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.489 . . . . 65.420000000000002 110.894 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.944 HD11 HG21 ' A' ' 12' ' ' THR . 1.1 pp -91.81 -27.05 18.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.249 -0.432 . . . . 74.200000000000003 110.9 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.717 ' N ' HD12 ' A' ' 136' ' ' LEU . 13.2 tpp -83.38 24.22 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.924 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 179.88 52.94 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 32.119999999999997 112.482 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 18.3 mtt-85 -64.82 -53.57 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.802 0.334 . . . . 71.129999999999995 110.907 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NE ' ' O ' ' A' ' 81' ' ' LYS . 1.0 OUTLIER -78.61 -41.94 30.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 61.509999999999998 110.837 -179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.578 ' CE1' ' O ' ' A' ' 80' ' ' SER . 6.6 m-70 -59.36 -61.11 2.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.010000000000005 110.814 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.421 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -58.62 -43.98 89.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.049999999999997 110.906 -179.887 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -53.59 -43.89 68.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 111.135 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -76.2 -47.06 25.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 74.25 110.84 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.792 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.83 -47.5 8.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 73.25 110.91 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.792 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.98 -34.75 32.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 43.329999999999998 110.887 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.42 -15.98 5.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 64.150000000000006 111.12 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.683 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.27 25.19 12.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.954 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.45 -15.93 57.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 73.400000000000006 112.46 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 64.72 -174.04 15.71 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.782 -0.723 . . . . 75.209999999999994 112.434 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 60.7 m95 -37.78 -27.4 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 70.439999999999998 110.869 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.5 t70 -69.72 -47.74 62.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.299 -0.41 . . . . 73.450000000000003 110.89 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -60.21 -32.36 76.26 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.789 -0.72 . . . . 74.239999999999995 112.478 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.901 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.3 t80 -67.02 -46.35 74.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.892 0.377 . . . . 63.450000000000003 110.896 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.779 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -52.88 -43.48 66.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 54.229999999999997 110.875 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.34 -26.53 42.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.540000000000006 110.868 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.5 ' O ' ' CD1' ' A' ' 157' ' ' PHE . 1.7 t80 -72.5 -40.07 67.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 71.439999999999998 110.906 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.693 ' HB2' HD11 ' A' ' 41' ' ' LEU . 13.0 m-85 -102.27 14.37 32.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.476 . . . . 63.109999999999999 110.941 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt 45.65 96.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 53.420000000000002 110.933 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.481 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 6.9 t-20 -70.08 143.36 91.33 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.587 0.708 . . . . 72.420000000000002 110.96 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.465 ' HG2' HD22 ' A' ' 162' ' ' LEU . 54.0 Cg_endo -69.74 -47.17 0.99 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.726 2.284 . . . . 75.109999999999999 112.311 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.501 HD23 ' HB1' ' A' ' 40' ' ' ALA . 3.7 mm? -66.24 150.67 96.73 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.572 0.701 . . . . 73.120000000000005 110.906 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.457 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.4 Cg_endo -69.83 -37.81 8.51 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.698 2.265 . . . . 74.140000000000001 112.337 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.457 HD22 ' HG2' ' A' ' 163' ' ' PRO . 1.9 mm? -51.49 -174.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.89 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.315 -1.114 . . . . 63.329999999999998 110.315 179.912 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.426 ' O ' ' CD ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.295 -1.122 . . . . 71.0 110.295 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.703 ' C ' HD12 ' A' ' -3' ' ' LEU . 53.7 Cg_endo -69.71 -8.39 23.48 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.708 2.272 . . . . 72.409999999999997 112.315 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.703 HD12 ' C ' ' A' ' -4' ' ' PRO . 7.3 mp -127.95 -175.45 3.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 74.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 111.14 152.37 12.48 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.725 -0.75 . . . . 55.229999999999997 112.507 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -120.17 140.96 50.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.829 0.347 . . . . 51.509999999999998 110.904 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 tpt -57.56 -42.63 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 71.0 110.853 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.573 ' HB3' ' OD1' ' A' ' 6' ' ' ASP . . . -125.45 177.7 6.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.257 -0.429 . . . . 72.540000000000006 111.088 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -87.22 -55.64 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 74.340000000000003 110.93 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.6 t -127.94 -7.52 5.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 72.439999999999998 110.914 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.448 ' HB2' ' CB ' ' A' ' 2' ' ' ALA . 9.7 mm-40 -72.97 -7.82 52.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.138 -0.483 . . . . 74.120000000000005 110.927 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.573 ' OD1' ' HB3' ' A' ' 2' ' ' ALA . 0.2 OUTLIER -107.57 86.99 3.11 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.654 0.74 . . . . 71.049999999999997 110.796 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.72 -0.23 6.58 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.753 2.302 . . . . 63.140000000000001 112.37 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -89.02 -26.06 21.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 73.140000000000001 110.971 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.546 ' CE1' ' HG3' ' A' ' 10' ' ' GLU . 2.1 p-80 -77.04 -41.47 42.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 63.509999999999998 110.863 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.546 ' HG3' ' CE1' ' A' ' 9' ' ' HIS . 1.4 mt-10 -77.54 -22.1 51.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.906 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' NH2' ' CD ' ' A' ' 38' ' ' GLU . 29.4 mtp85 -75.2 -40.9 58.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.869 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.038 HG21 HD11 ' A' ' 136' ' ' LEU . 91.2 m -70.83 -39.78 72.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.153 -0.476 . . . . 72.340000000000003 111.152 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 5.2 tpp85 -59.31 -54.96 40.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.428 . . . . 73.109999999999999 110.902 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.62 -42.56 99.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 71.319999999999993 110.908 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.769 HD11 HD22 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.78 -46.36 89.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.96 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.805 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -68.57 -49.39 59.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.147 -0.479 . . . . 52.329999999999998 110.886 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 m -64.85 -34.1 77.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 75.319999999999993 110.81 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.41 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.9 OUTLIER -61.37 -38.66 87.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 54.409999999999997 110.875 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.574 ' CE2' ' HA3' ' A' ' 98' ' ' GLY . 40.6 t80 -63.95 -45.99 86.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.892 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.693 HG22 ' HG2' ' A' ' 101' ' ' MET . 2.7 mm -50.77 -49.14 27.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 71.010000000000005 111.149 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.19 -49.9 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 55.43 110.891 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.613 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.89 -33.98 65.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 74.340000000000003 110.906 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.38 -13.03 53.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 61.439999999999998 110.843 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.978 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -81.98 17.14 1.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 71.329999999999998 111.117 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.477 HH12 HD22 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -110.38 112.7 24.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 45.229999999999997 110.859 -179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -35.54 153.67 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.586 0.708 . . . . 71.099999999999994 110.902 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.88 -10.19 27.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.695 2.263 . . . . 61.539999999999999 112.304 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -89.58 5.78 44.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 72.230000000000004 110.861 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 t -140.24 140.5 23.55 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-O 121.536 0.684 . . . . 74.409999999999997 111.153 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 136.73 33.72 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.647 2.231 . . . . 54.210000000000001 112.323 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.571 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -76.25 155.14 84.27 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.585 0.707 . . . . 73.040000000000006 110.893 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 169.9 17.87 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.682 2.254 . . . . 74.239999999999995 112.316 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 170.41 16.72 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.727 2.285 . . . . 74.340000000000003 112.268 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.69 -172.09 0.53 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.747 2.298 . . . . 73.219999999999999 112.319 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.41 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.2 OUTLIER -130.16 -44.15 1.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 73.120000000000005 111.215 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.489 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.4 OUTLIER -134.32 -178.38 5.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.48 . . . . 54.140000000000001 110.835 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.448 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -61.44 -46.67 96.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.125 -0.488 . . . . 75.450000000000003 111.084 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.725 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.5 pt-20 -64.35 -30.15 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 74.200000000000003 110.88 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.489 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.96 -35.24 64.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 63.119999999999997 111.092 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.33 -54.18 32.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.432 . . . . 73.010000000000005 111.164 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.847 HD12 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -62.59 -51.73 66.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 74.040000000000006 110.923 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.868 HD13 HD23 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.66 -42.45 56.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 71.349999999999994 110.954 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -65.43 -24.86 67.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 71.319999999999993 110.924 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -88.07 -36.81 16.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.340000000000003 110.826 -179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.665 HG13 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -91.57 -51.29 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 111.181 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.766 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -56.4 -33.22 65.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 52.409999999999997 111.202 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.44 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -59.55 -32.95 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 74.5 110.889 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.33 -29.27 38.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.430000000000007 110.939 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 16.3 mm -65.28 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 44.329999999999998 111.152 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.2 mt-30 -81.34 -61.45 1.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 75.109999999999999 110.953 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -47.68 -20.0 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 75.430000000000007 110.88 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.69 -41.97 8.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.157 -0.474 . . . . 72.120000000000005 110.858 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.631 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 79.0 m-70 -103.21 -44.31 5.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 71.049999999999997 110.912 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -24.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 110.934 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.96 -39.6 12.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.22 -0.446 . . . . 44.409999999999997 110.915 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -95.46 -39.2 10.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 72.219999999999999 110.847 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.631 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 9.9 m-30 -52.59 -59.53 4.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 64.109999999999999 110.881 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 t -49.8 -43.11 48.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.153 -0.476 . . . . 53.140000000000001 110.919 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.4 m -51.85 -34.81 42.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.508 . . . . 70.409999999999997 110.976 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -80.29 -40.87 25.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 74.040000000000006 110.886 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -47.01 -43.99 20.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.095 -0.502 . . . . 74.299999999999997 110.877 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.485 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 6.9 mt-10 -99.39 29.81 3.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 110.893 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.416 ' HB3' ' CD ' ' A' ' 64' ' ' ARG . 9.1 t -118.27 -68.7 0.9 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.240000000000002 110.796 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.588 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.4 OUTLIER -96.22 -18.44 20.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 71.409999999999997 110.922 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.65 4.92 72.11 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.682 -0.771 . . . . 72.109999999999999 112.522 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.924 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.57 32.19 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.79 0.328 . . . . 73.540000000000006 110.812 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.739 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -31.51 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 72.109999999999999 110.853 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.1 tp -77.77 -52.49 8.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 110.91 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 79.1 mt-10 -51.36 -33.95 31.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 63.200000000000003 110.854 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.924 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.26 -36.04 58.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.040000000000006 110.938 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.882 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -62.09 -45.43 98.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 54.340000000000003 111.169 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.7 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.74 -42.65 63.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.124 -0.489 . . . . 75.219999999999999 110.827 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.74 -48.9 72.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 64.040000000000006 110.884 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.719 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 13.4 mmm -58.35 -54.84 42.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 72.519999999999996 110.89 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.469 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.76 -21.55 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 52.229999999999997 111.061 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.03 -30.06 28.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 64.129999999999995 110.907 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.899 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.9 ptpt -80.55 -48.47 12.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 75.340000000000003 110.865 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.924 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.82 -61.39 1.88 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 71.209999999999994 110.897 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.924 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.6 156.04 21.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 43.399999999999999 110.953 179.889 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.452 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.91 -168.5 1.46 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 63.409999999999997 110.894 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.474 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.2 pttm -101.03 -53.69 2.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 75.409999999999997 110.923 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -91.06 12.36 20.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.236 -0.438 . . . . 74.239999999999995 110.841 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.586 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -106.0 128.7 54.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 73.450000000000003 110.874 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.89 72.48 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 110.87 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.621 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -58.65 122.14 12.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.340000000000003 110.866 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.0 t -92.76 162.88 13.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 64.420000000000002 110.892 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.903 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 17.6 m95 -51.98 -39.84 60.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 74.030000000000001 110.884 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -53.77 -33.42 55.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.318 -0.401 . . . . 52.350000000000001 110.86 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -73.5 -40.04 64.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.150000000000006 110.954 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.903 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -55.68 -56.02 25.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.329999999999998 110.942 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.6 m -61.53 -31.98 52.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 63.140000000000001 111.1 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.6 tmm? -59.64 -46.14 89.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 75.219999999999999 110.844 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.441 HD21 ' CA ' ' A' ' 75' ' ' ALA . 7.4 mt -59.45 -44.91 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.248 -0.433 . . . . 73.230000000000004 110.895 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.868 HD23 HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -56.7 -51.92 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.439999999999998 110.897 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.766 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.87 -58.31 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.409999999999997 111.121 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.884 ' CE2' HD11 ' A' ' 100' ' ' LEU . 59.6 t80 -51.28 -60.44 3.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 70.439999999999998 110.844 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.004 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.99 -51.9 2.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 111.08 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.574 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.13 -30.65 78.37 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.717 -0.754 . . . . 71.420000000000002 112.492 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -67.52 -26.06 66.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.768 0.318 . . . . 75.140000000000001 111.137 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.943 HD12 HD11 ' A' ' 128' ' ' ILE . 2.7 mt -84.17 -21.21 31.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.224 -0.444 . . . . 64.519999999999996 110.966 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.693 ' HG2' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.66 93.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 71.329999999999998 110.899 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.515 ' ND2' ' CG1' ' A' ' 120' ' ' ILE . 0.3 OUTLIER -62.86 142.0 58.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 72.349999999999994 110.901 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.978 ' NE2' ' HB1' ' A' ' 24' ' ' ALA . 39.3 mm-40 -144.53 126.34 15.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 51.350000000000001 110.954 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.609 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.47 42.52 0.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 74.209999999999994 112.476 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.0 Cg_endo -69.79 -163.23 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.712 2.275 . . . . 74.540000000000006 112.375 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.9 t80 -124.31 -10.04 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 73.519999999999996 110.89 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.487 ' HE1' ' OD1' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -36.9 96.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 110.889 179.93 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.555 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . . . -97.21 -152.09 0.38 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 64.010000000000005 111.059 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.847 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -66.33 -85.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.234 -0.439 . . . . 71.299999999999997 111.176 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.847 ' N ' HG22 ' A' ' 109' ' ' VAL . 14.3 mttt -69.88 95.49 0.92 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 72.140000000000001 110.866 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.555 ' NE2' ' HB3' ' A' ' 108' ' ' ALA . 19.0 mm-40 -142.93 166.32 24.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 73.219999999999999 110.913 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -154.72 159.63 40.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.192 -0.458 . . . . 71.030000000000001 110.951 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.453 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.2 OUTLIER 34.28 35.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.286 -0.416 . . . . 63.009999999999998 110.823 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.487 ' OD1' ' HE1' ' A' ' 107' ' ' MET . 6.6 m-20 -99.39 1.27 44.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 62.130000000000003 110.909 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.477 HD22 HH12 ' A' ' 25' ' ' ARG . 4.6 mt -45.87 -20.92 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 64.219999999999999 110.918 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . -76.72 59.55 3.39 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.814 -0.707 . . . . 54.439999999999998 112.462 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.919 ' ND2' HG11 ' A' ' 121' ' ' VAL . 12.7 p-10 -35.64 153.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.802 0.334 . . . . 73.420000000000002 110.903 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 120' ' ' ILE . 6.7 mmt85 -40.86 162.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 64.120000000000005 110.823 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.732 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.4 -12.6 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 71.329999999999998 111.09 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.866 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -54.19 -30.18 20.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.120000000000005 111.155 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.919 HG11 ' ND2' ' A' ' 117' ' ' ASN . 0.2 OUTLIER -70.55 -48.9 56.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 111.142 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.732 ' CG2' HG12 ' A' ' 119' ' ' VAL . 3.0 t -66.8 -43.27 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 64.329999999999998 111.087 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -61.58 -41.65 97.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 72.010000000000005 110.977 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.523 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 0.6 OUTLIER -74.55 -29.34 61.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.95 179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.685 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -68.23 -45.05 74.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 71.109999999999999 110.886 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.4 t -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.140000000000001 110.846 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.7 mt -75.1 -54.25 7.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.0 110.947 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.943 HD11 HD12 ' A' ' 100' ' ' LEU . 4.6 tt -58.81 -47.21 89.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 111.158 179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.795 HG13 ' HB3' ' A' ' 16' ' ' LEU . 48.4 t -70.45 -33.12 52.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 71.140000000000001 111.113 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.51 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.2 OUTLIER -58.31 -37.31 74.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 74.129999999999995 110.872 -179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.7 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.0 t80 -71.97 -55.98 6.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 110.869 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.004 HD11 ' HB2' ' A' ' 97' ' ' ALA . 5.8 mt -63.78 -54.81 29.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.209999999999994 110.991 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.566 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 66.9 t80 -44.47 -47.97 10.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.409999999999997 110.935 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.703 ' ND2' HD21 ' A' ' -3' ' ' LEU . 84.5 m-20 -73.42 -28.68 62.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.043 -0.526 . . . . 43.539999999999999 110.896 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.522 ' O ' ' CG ' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -57.84 -53.68 55.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 110.931 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.038 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -86.72 -16.87 35.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 74.310000000000002 110.965 179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.929 ' N ' HD13 ' A' ' 136' ' ' LEU . 14.6 tpp -94.52 23.99 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 64.310000000000002 110.874 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.06 166.71 40.96 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 72.319999999999993 112.469 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.426 ' CD ' ' O ' ' A' ' -5' ' ' GLY . 10.8 mtm180 -54.75 -53.73 51.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.803 0.335 . . . . 74.230000000000004 110.853 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.474 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.1 -43.29 29.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.846 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 13.1 m-70 -59.63 -61.19 2.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 62.509999999999998 110.852 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.485 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.38 -47.22 66.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 60.229999999999997 110.83 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.39 -43.63 54.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 32.100000000000001 111.076 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 13.0 mmt180 -76.46 -47.79 21.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 62.25 110.854 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.778 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.2 OUTLIER -43.68 -47.3 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 62.030000000000001 110.962 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.778 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.96 -35.26 32.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 74.140000000000001 110.896 179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -16.37 5.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 72.540000000000006 111.084 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.672 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.0 25.62 11.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 63.509999999999998 110.983 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 102.66 -21.25 41.32 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.739 -0.743 . . . . 60.140000000000001 112.561 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 67.76 -175.89 25.95 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.78 -0.724 . . . . 74.329999999999998 112.494 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.484 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 49.9 m95 -37.6 -27.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 73.099999999999994 110.952 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -65.91 -47.33 75.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.853 179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.49 -28.32 72.23 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.757 -0.735 . . . . 51.340000000000003 112.399 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.622 ' HB2' ' CZ3' ' A' ' 87' ' ' TRP . 1.7 t80 -65.37 -52.3 54.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 75.409999999999997 110.907 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.847 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -56.7 -42.85 79.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 64.109999999999999 110.948 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.575 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.53 -26.76 41.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 74.340000000000003 110.923 -179.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.532 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 1.7 t80 -68.21 -44.2 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 75.25 110.953 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.708 ' HB2' HD11 ' A' ' 41' ' ' LEU . 20.5 m-85 -98.75 7.95 45.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 73.329999999999998 110.895 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 52.0 104.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.15 -0.477 . . . . 73.239999999999995 110.954 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.4 OUTLIER -73.58 148.52 87.87 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.619 0.723 . . . . 42.509999999999998 110.844 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.445 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.8 -46.13 1.32 Allowed 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.647 2.231 . . . . 51.549999999999997 112.343 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.483 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -59.33 159.51 15.81 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.704 0.764 . . . . 75.400000000000006 110.901 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.646 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.5 Cg_endo -69.76 -49.31 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.658 2.238 . . . . 70.430000000000007 112.321 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.646 HD22 ' HG2' ' A' ' 163' ' ' PRO . 1.8 mm? -51.6 -174.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 110.999 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.433 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.486 0 N-CA-C 110.27 -1.132 . . . . 74.430000000000007 110.27 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.524 0 N-CA-C 110.264 -1.134 . . . . 64.409999999999997 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.427 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.2 Cg_endo -69.79 -9.77 26.9 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.731 2.288 . . . . 72.540000000000006 112.309 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.541 HD23 ' SD ' ' A' ' 1' ' ' MET . 8.8 tp -35.94 153.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.225 -0.443 . . . . 72.400000000000006 110.893 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 1' ' ' MET . . . -65.63 143.75 45.96 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.709 -0.758 . . . . 74.239999999999995 112.487 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 72.6 m -55.23 84.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 70.049999999999997 110.886 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.541 ' SD ' HD23 ' A' ' -3' ' ' LEU . 1.9 ptm -90.84 -53.67 4.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.107 -0.497 . . . . 71.109999999999999 110.869 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.552 ' HB3' ' HG3' ' A' ' 5' ' ' GLN . . . -177.4 177.37 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 61.130000000000003 111.114 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -113.45 -34.47 5.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 70.420000000000002 110.843 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.472 ' O ' ' CG ' ' A' ' 9' ' ' HIS . 52.4 p -80.49 6.05 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 110.812 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.552 ' HG3' ' HB3' ' A' ' 2' ' ' ALA . 3.2 mt-30 -83.39 -14.0 53.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 62.509999999999998 110.927 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -53.36 162.71 1.11 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.606 0.717 . . . . 40.509999999999998 110.891 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -48.79 0.65 Allowed 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.704 2.269 . . . . 74.030000000000001 112.408 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD11 ' NE ' ' A' ' 142' ' ' ARG . 0.2 OUTLIER -90.8 1.7 56.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.420000000000002 110.956 179.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.65 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 1.4 p80 -41.65 -54.15 3.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 61.439999999999998 110.852 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.65 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.2 tp10 -73.68 -19.06 60.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.310000000000002 110.868 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' NE ' ' HA ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -74.9 -31.6 61.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 61.509999999999998 110.91 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.047 HG21 HD21 ' A' ' 136' ' ' LEU . 54.5 m -78.3 -45.19 23.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 72.400000000000006 111.115 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -58.37 -46.95 85.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 65.519999999999996 110.848 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.505 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.94 -45.79 84.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.825 -179.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -61.37 -49.88 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 63.43 110.952 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.731 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.7 mp -62.0 -51.4 68.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 110.902 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.4 ' HA ' HG12 ' A' ' 20' ' ' ILE . 82.5 p -62.04 -39.0 90.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.430000000000007 110.925 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.427 ' CG ' ' HG1' ' A' ' 35' ' ' THR . 29.2 m-20 -56.2 -44.2 79.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 73.239999999999995 110.837 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -61.28 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 64.310000000000002 110.906 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.518 HG13 ' CG2' ' A' ' 129' ' ' VAL . 6.0 mm -50.82 -44.58 26.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 64.109999999999999 111.104 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.97 -52.11 66.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 73.299999999999997 110.857 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' CE2' ' HG3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -56.01 -44.49 78.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.857 -179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -64.64 -17.81 64.37 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 110.862 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -83.39 16.64 2.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 111.038 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.6 mmt-85 -114.63 112.74 23.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.894 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -53.01 162.59 1.0 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.596 0.712 . . . . 74.049999999999997 110.887 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -14.7 36.43 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.702 2.268 . . . . 53.219999999999999 112.356 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -94.95 5.63 51.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 63.340000000000003 110.867 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -136.05 140.98 34.74 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.652 0.739 . . . . 64.129999999999995 111.161 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 137.67 36.15 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.715 2.276 . . . . 62.409999999999997 112.341 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 1.0 OUTLIER -103.28 162.84 18.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.661 0.743 . . . . 75.109999999999999 110.852 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 160.73 48.61 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.705 2.27 . . . . 64.549999999999997 112.343 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 170.11 17.36 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.683 2.255 . . . . 64.120000000000005 112.311 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 152.8 69.01 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.716 2.277 . . . . 75.140000000000001 112.317 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.452 HG21 ' NE ' ' A' ' 14' ' ' ARG . 1.5 m -81.22 -55.71 4.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 73.439999999999998 111.141 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.542 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 1.1 t -152.59 178.21 9.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.285 -0.416 . . . . 70.140000000000001 110.859 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.607 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.2 t -43.2 -54.19 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 54.43 111.106 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.702 ' HB2' HD22 ' A' ' 15' ' ' LEU . 7.1 pt-20 -53.02 -38.61 62.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 53.200000000000003 110.912 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.66 -32.65 66.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 50.109999999999999 111.115 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -72.13 -30.81 65.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 111.091 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -66.71 -49.43 66.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.463 . . . . 75.129999999999995 110.898 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.089 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -56.75 -56.01 26.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.94 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.501 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.14 -26.1 15.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.15 -0.477 . . . . 71.340000000000003 110.841 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.449 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 1.7 t -85.52 -49.54 7.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 64.420000000000002 110.878 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.778 HG11 ' CD2' ' A' ' 158' ' ' PHE . 10.8 m -93.19 -51.45 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.107 -0.497 . . . . 61.109999999999999 111.117 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.768 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.06 -32.0 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 111.112 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.571 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.4 -33.01 71.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 71.120000000000005 110.862 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.571 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.21 -33.39 38.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 70.450000000000003 110.871 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.486 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 10.6 mm -63.06 -31.72 53.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 111.148 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.3 mt-30 -81.5 -61.58 1.9 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.489 . . . . 73.209999999999994 110.897 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.36 -19.81 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.247 -0.433 . . . . 70.219999999999999 110.881 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.519 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 13.5 pt-20 -96.96 -42.31 7.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.958 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.643 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 76.9 m-70 -102.99 -43.72 5.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.82 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.75 -23.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.927 -179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -32.29 2.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.207 -0.451 . . . . 72.030000000000001 110.939 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -104.31 -36.62 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 65.530000000000001 110.82 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.652 ' CB ' HG21 ' A' ' 99' ' ' THR . 7.6 m-30 -53.41 -55.65 23.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.129999999999995 110.91 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -49.92 -45.63 51.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 75.510000000000005 110.794 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.4 t -51.84 -35.6 45.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.851 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -75.27 -44.94 43.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 74.200000000000003 110.811 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.436 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -49.95 -22.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.796 -179.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.436 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 7.2 mt-10 -122.2 33.01 5.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 71.140000000000001 110.904 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 t -118.06 -68.37 0.92 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 53.43 110.814 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 0.3 OUTLIER -104.14 -15.15 15.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 54.310000000000002 110.907 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 77.34 5.66 85.76 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.748 -0.739 . . . . 70.150000000000006 112.515 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.594 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -83.62 31.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.854 0.359 . . . . 72.400000000000006 110.829 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.653 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.22 -33.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.156 -0.474 . . . . 64.099999999999994 110.893 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -77.67 -51.75 10.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 44.130000000000003 110.915 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.489 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 0.2 OUTLIER -51.11 -34.44 30.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.17 -0.468 . . . . 62.32 110.863 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.603 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -76.78 -38.57 53.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.937 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 1.023 HG21 HG12 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.94 -47.8 91.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 111.157 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.633 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -72.73 -34.2 66.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 52.340000000000003 110.89 179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.485 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.1 mp0 -63.47 -47.6 81.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.25 -0.432 . . . . 73.200000000000003 110.914 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.652 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 9.8 mmm -60.99 -55.51 32.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 74.340000000000003 110.851 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.893 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.23 -22.66 4.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 44.240000000000002 111.084 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.09 -28.06 29.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 70.230000000000004 110.87 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.955 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.8 ptpt -81.78 -48.7 11.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 64.319999999999993 110.902 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.47 -59.95 2.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.297 -0.41 . . . . 70.239999999999995 110.919 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.57 152.7 22.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 44.119999999999997 110.895 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.61 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -152.73 -174.08 4.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 64.519999999999996 110.85 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.461 ' HB2' ' CD ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.22 -46.04 5.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 51.409999999999997 110.9 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -14.43 41.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 73.439999999999998 110.796 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' SER . 1.1 mp0 -92.6 127.41 38.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 52.299999999999997 110.946 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.59 73.53 5.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.207 -0.451 . . . . 53.329999999999998 110.868 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.541 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -45.16 164.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.177 -0.465 . . . . 62.509999999999998 110.844 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.0 158.37 21.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 63.109999999999999 110.847 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.976 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 3.2 m95 -48.77 -28.41 3.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 72.140000000000001 110.942 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.2 -36.79 83.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 55.200000000000003 110.847 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.505 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.9 mm100 -75.0 -38.65 61.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.121 -0.49 . . . . 61.020000000000003 110.887 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.976 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -54.89 -56.41 19.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 52.420000000000002 110.817 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 13.1 m -64.01 -31.89 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 72.030000000000001 111.138 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.432 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -61.7 -43.16 99.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 73.150000000000006 110.848 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.767 HD23 ' C ' ' A' ' 93' ' ' LEU . 1.8 tt -62.06 -40.81 97.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.232 -0.44 . . . . 64.219999999999999 110.951 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.849 HD12 HD22 ' A' ' 42' ' ' LEU . 9.4 mt -62.51 -48.57 78.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.310000000000002 110.865 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.768 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.56 -48.66 76.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 72.409999999999997 111.079 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.933 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.0 t80 -55.78 -60.34 3.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.27 -0.423 . . . . 71.409999999999997 110.873 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.82 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -42.3 -50.05 5.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 61.210000000000001 111.07 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -63.83 -25.53 69.25 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.784 -0.722 . . . . 40.140000000000001 112.464 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -76.96 -27.48 54.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.855 0.36 . . . . 52.399999999999999 111.154 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.933 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -81.39 -36.13 29.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.212 -0.449 . . . . 64.400000000000006 110.89 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.453 ' SD ' ' C ' ' A' ' 101' ' ' MET . 1.7 tpp -35.48 103.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.465 . . . . 45.229999999999997 110.86 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.462 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -102.55 161.75 13.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 73.109999999999999 110.862 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.449 ' HA ' ' CG1' ' A' ' 120' ' ' ILE . 1.6 mm100 -133.72 -178.65 5.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 71.230000000000004 110.922 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 167.07 59.41 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.725 -0.75 . . . . 75.439999999999998 112.481 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.406 ' HB2' ' HG3' ' A' ' 107' ' ' MET . 53.5 Cg_endo -69.78 -161.95 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 70.310000000000002 112.279 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.58 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 5.2 t80 -116.35 -9.11 11.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.185 -0.461 . . . . 74.0 110.94 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.75 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.31 90.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.067 -0.515 . . . . 75.129999999999995 110.864 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.549 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.03 -153.86 0.5 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 74.510000000000005 111.081 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.853 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -65.28 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 75.239999999999995 111.114 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.853 ' N ' HG22 ' A' ' 109' ' ' VAL . 4.0 tttt -70.76 92.44 0.88 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 64.439999999999998 110.913 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.404 ' CD ' ' H ' ' A' ' 108' ' ' ALA . 35.3 mm-40 -135.5 131.63 36.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 72.510000000000005 110.906 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -64.32 -76.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.019999999999996 110.908 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 -80.8 -178.38 6.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 74.329999999999998 110.789 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -126.51 -28.97 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 74.420000000000002 110.907 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -56.17 -13.08 1.81 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 61.340000000000003 110.868 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 115' ' ' LEU . . . -36.17 113.78 0.17 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.745 -0.74 . . . . 70.219999999999999 112.532 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -140.91 127.96 20.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.847 0.356 . . . . 74.230000000000004 110.927 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.674 ' HB3' HG23 ' A' ' 120' ' ' ILE . 26.9 mmt-85 -69.93 164.22 24.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 74.209999999999994 110.896 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.555 ' CG2' HG23 ' A' ' 122' ' ' THR . 11.5 p -75.37 -13.66 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 111.173 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.674 HG23 ' HB3' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -49.56 -22.87 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 54.210000000000001 111.076 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.633 ' H ' HD13 ' A' ' 120' ' ' ILE . 7.7 p -76.44 -53.75 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 75.239999999999995 111.152 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.628 ' N ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -71.26 -44.69 64.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 75.319999999999993 111.148 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.549 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 2.4 ptm180 -55.33 -51.12 67.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 73.209999999999994 110.846 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.549 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 85.8 m-20 -70.56 -27.99 64.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 73.519999999999996 110.876 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.847 ' O ' HG23 ' A' ' 129' ' ' VAL . 31.0 t -71.24 -39.33 71.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 62.039999999999999 110.835 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -65.39 -40.88 94.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.86 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 9.6 mt -75.1 -47.64 27.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 64.319999999999993 110.939 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 1.023 HG12 HG21 ' A' ' 71' ' ' VAL . 6.5 tt -59.52 -46.66 92.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 73.430000000000007 111.205 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.847 HG23 ' O ' ' A' ' 125' ' ' CYS . 20.5 t -73.32 -30.84 31.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 63.420000000000002 111.14 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.8 -49.33 68.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 44.039999999999999 110.877 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.633 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 7.9 t80 -67.49 -53.43 28.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.219999999999999 110.896 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.82 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.3 OUTLIER -57.53 -56.44 21.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.129 -0.487 . . . . 62.100000000000001 110.994 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.679 ' O ' HD23 ' A' ' 136' ' ' LEU . 3.2 t80 -41.69 -58.18 2.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 110.923 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.442 ' OD1' ' HA ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -66.67 -28.05 68.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.123 -0.49 . . . . 54.43 110.896 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.893 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.01 -46.7 82.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 60.130000000000003 110.906 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.047 HD21 HG21 ' A' ' 12' ' ' THR . 0.6 OUTLIER -100.32 -18.78 16.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.448 . . . . 51.350000000000001 110.913 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.75 ' N ' HD23 ' A' ' 136' ' ' LEU . 14.4 tpp -93.23 24.35 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 63.25 110.907 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.65 168.64 40.0 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.81 -0.71 . . . . 64.340000000000003 112.522 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -57.7 -51.79 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 74.329999999999998 110.869 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.461 ' CD ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -77.26 -42.23 37.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 72.120000000000005 110.845 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.61 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.7 m80 -63.25 -61.26 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 71.099999999999994 110.906 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.619 ' NE ' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.92 -50.46 57.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 72.140000000000001 110.906 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.74 -41.46 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.246 -0.434 . . . . 72.549999999999997 111.088 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.44 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 15.9 mmt180 -76.63 -37.28 56.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 75.209999999999994 110.914 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -59.04 -43.79 91.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 63.100000000000001 110.874 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.617 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.7 OUTLIER -81.1 -35.25 31.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 63.32 110.883 179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.12 -15.1 0.76 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 74.319999999999993 111.094 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.3 OUTLIER -111.23 25.26 11.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 70.010000000000005 110.972 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.57 3.69 62.62 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.748 -0.739 . . . . 73.420000000000002 112.482 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.485 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.97 -171.83 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.746 -0.74 . . . . 64.310000000000002 112.469 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CZ2' HD11 ' A' ' 136' ' ' LEU . 80.5 m95 -40.21 -25.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.826 0.346 . . . . 64.239999999999995 110.916 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.7 OUTLIER -63.14 -47.65 81.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 72.010000000000005 110.858 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -69.78 -30.18 70.65 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 63.020000000000003 112.534 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.7 ' CE1' ' CG1' ' A' ' 91' ' ' VAL . 4.9 t80 -67.1 -57.25 7.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.856 0.36 . . . . 61.340000000000003 110.935 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.607 ' SG ' HG12 ' A' ' 37' ' ' VAL . 30.4 m -51.65 -41.15 61.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 53.409999999999997 110.889 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.581 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.5 -26.71 41.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 75.040000000000006 110.822 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.419 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 10.3 t80 -69.82 -42.83 73.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 62.200000000000003 110.915 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 41.5 m-85 -89.59 -16.38 30.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 110.875 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 78.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.209999999999994 110.862 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.494 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -48.85 150.11 2.81 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.609 0.718 . . . . 70.230000000000004 110.912 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.435 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -47.87 0.82 Allowed 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.679 2.252 . . . . 61.020000000000003 112.312 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.494 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 4.3 mm? -59.17 160.27 12.48 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.615 0.722 . . . . 61.109999999999999 110.865 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 162' ' ' LEU . 54.0 Cg_endo -69.78 -43.81 2.42 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.601 2.201 . . . . 73.319999999999993 112.407 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.6 mp -48.86 171.62 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 70.120000000000005 110.852 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.308 -1.117 . . . . 73.219999999999999 110.308 179.902 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.478 0 N-CA-C 110.288 -1.125 . . . . 33.420000000000002 110.288 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -49.33 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.707 2.272 . . . . 74.219999999999999 112.33 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.681 HD13 ' N ' ' A' ' -2' ' ' GLY . 0.3 OUTLIER -42.59 136.63 2.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 62.539999999999999 110.915 179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.681 ' N ' HD13 ' A' ' -3' ' ' LEU . . . -149.45 -144.76 4.0 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.703 -0.76 . . . . 63.140000000000001 112.476 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' -2' ' ' GLY . 0.7 OUTLIER -34.54 129.78 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.909 0.385 . . . . 54.420000000000002 110.851 -179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.514 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 2.4 ptp -84.25 -49.15 9.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 60.310000000000002 110.867 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.514 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -100.02 161.85 13.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 64.400000000000006 111.122 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -134.71 3.07 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.884 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.0 t -100.79 -19.31 16.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 71.030000000000001 110.862 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -93.54 46.44 1.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 72.209999999999994 110.944 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -112.87 86.88 9.41 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.546 0.688 . . . . 53.240000000000002 110.844 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -90.85 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.65 2.233 . . . . 63.229999999999997 112.389 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.698 HD13 HH21 ' A' ' 142' ' ' ARG . 10.4 mp -83.28 22.05 1.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.932 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.646 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 5.8 p-80 -61.89 -54.12 46.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 73.349999999999994 110.835 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.646 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 6.3 tt0 -79.58 -34.77 40.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 64.230000000000004 110.897 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.448 ' HD2' ' N ' ' A' ' 11' ' ' ARG . 1.4 mpt_? -56.82 -42.38 79.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 75.150000000000006 110.926 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.977 ' CG2' HD21 ' A' ' 136' ' ' LEU . 53.3 m -78.03 -42.13 33.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 75.329999999999998 111.156 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -57.69 -55.0 40.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 61.0 110.849 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.84 -47.29 83.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 110.84 -179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.799 HD22 ' CD ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.91 -52.79 64.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.166 -0.47 . . . . 43.520000000000003 110.898 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.665 HD11 HD11 ' A' ' 94' ' ' LEU . 3.9 mp -55.28 -52.52 63.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 64.319999999999993 110.958 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -62.04 -34.65 76.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 61.149999999999999 110.872 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' CG ' ' CB ' ' A' ' 35' ' ' THR . 1.2 m-20 -59.28 -35.94 74.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.107 -0.497 . . . . 72.209999999999994 110.912 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.788 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.9 t80 -73.58 -33.64 64.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.464 . . . . 74.510000000000005 110.91 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.771 HG23 ' HG3' ' A' ' 101' ' ' MET . 24.8 mm -56.75 -48.18 81.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.516 . . . . 73.510000000000005 111.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -65.16 -47.2 77.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.872 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 2.6 t80 -55.8 -32.33 63.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 71.340000000000003 110.859 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -78.43 -29.02 46.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 63.109999999999999 110.867 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -82.54 4.95 22.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.475 . . . . 72.150000000000006 111.067 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' C ' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -32.41 111.83 0.1 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.842 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.73 ' HB2' HG22 ' A' ' 29' ' ' THR . 20.5 mm-40 -49.02 149.46 3.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.612 0.72 . . . . 70.530000000000001 110.938 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -10.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 75.150000000000006 112.318 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -109.23 5.87 24.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.873 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.73 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.3 t -153.22 141.17 13.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.568 0.699 . . . . 72.349999999999994 111.143 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.65 165.34 31.17 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.641 2.228 . . . . 62.530000000000001 112.386 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' CG ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER -73.37 141.86 80.86 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.719 . . . . 65.310000000000002 110.927 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 169.61 18.59 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.69 2.26 . . . . 60.32 112.323 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 170.25 16.94 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.719 2.279 . . . . 74.219999999999999 112.368 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 136.38 32.68 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.687 2.258 . . . . 63.210000000000001 112.301 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.531 ' CG2' ' N ' ' A' ' 36' ' ' SER . 0.6 OUTLIER -70.72 -44.68 66.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.203 -0.453 . . . . 64.200000000000003 111.176 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.54 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.1 m -142.04 -177.37 5.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 70.219999999999999 110.883 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.402 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.5 t -61.45 -43.43 96.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 65.209999999999994 111.177 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.799 ' CD ' HD22 ' A' ' 15' ' ' LEU . 20.2 pt-20 -66.93 -32.15 73.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 73.010000000000005 110.882 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.54 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.7 -24.84 59.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 72.310000000000002 111.108 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.49 -52.66 12.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 50.219999999999999 111.075 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.863 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -56.06 -53.2 59.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 73.099999999999994 110.915 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.056 HD13 HD23 ' A' ' 94' ' ' LEU . 15.0 mt -52.68 -44.81 66.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.258 -0.428 . . . . 71.310000000000002 110.84 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.445 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -58.94 -24.77 62.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 70.120000000000005 110.804 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.438 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -90.33 -42.26 11.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.417 . . . . 73.409999999999997 110.86 -179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.639 HG13 ' O ' ' A' ' 41' ' ' LEU . 0.8 OUTLIER -89.53 -51.33 12.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 51.520000000000003 111.066 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.788 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -53.65 -34.35 58.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 64.430000000000007 111.085 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.02 -30.68 70.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.884 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.02 -33.2 39.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 71.129999999999995 110.885 -179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.493 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.6 mm -61.66 -31.33 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.186 -0.461 . . . . 53.229999999999997 111.108 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -80.64 -60.87 2.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 74.200000000000003 110.928 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -46.88 -20.05 0.12 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.931 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.572 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 18.7 pt-20 -96.67 -43.08 7.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.030000000000001 110.849 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.613 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.7 m-70 -101.96 -43.42 5.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.11 -0.495 . . . . 73.209999999999994 110.878 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.26 -25.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 72.430000000000007 110.85 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.16 -39.06 9.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 70.219999999999999 110.891 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 36.4 m-85 -95.54 -40.28 9.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.340000000000003 110.905 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.8 m-30 -53.84 -53.62 49.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.904 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 29.7 t -49.94 -45.38 51.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.907 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 61.2 m -51.75 -38.41 55.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.887 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 89.9 m-85 -78.95 -40.33 32.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.010000000000005 110.856 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -49.05 -27.49 3.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 110.832 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -122.02 32.94 5.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 65.230000000000004 110.843 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.11 -68.16 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 55.229999999999997 110.861 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.401 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 17.9 mmt180 -98.37 -14.96 19.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 64.209999999999994 110.878 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 74.11 7.69 77.31 Favored Glycine 0 N--CA 1.453 -0.22 0 C-N-CA 120.742 -0.742 . . . . 71.340000000000003 112.424 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.511 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.2 30.58 0.52 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.803 0.335 . . . . 71.340000000000003 110.861 -179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.752 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.02 -34.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 61.340000000000003 110.942 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.0 tp -79.31 -51.18 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 70.230000000000004 110.906 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 46.6 mt-10 -50.41 -32.9 18.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 73.239999999999995 110.826 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -77.86 -38.52 45.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 53.340000000000003 110.918 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.843 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.87 -45.34 91.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 64.319999999999993 111.17 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.697 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -73.02 -44.78 60.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 73.099999999999994 110.868 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -54.96 -50.18 69.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 62.530000000000001 110.88 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.838 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.6 mmm -59.61 -55.77 30.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 73.200000000000003 110.887 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.659 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -52.07 -21.75 3.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 111.074 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -83.78 -28.96 27.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.202 -0.454 . . . . 74.010000000000005 110.885 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.921 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.8 ptpt -81.12 -48.6 11.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 60.520000000000003 110.918 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.921 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.66 -57.77 3.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.259 -0.428 . . . . 74.129999999999995 110.899 179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.907 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.69 156.47 18.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 75.140000000000001 110.908 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.459 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -165.92 -169.7 1.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 70.510000000000005 110.847 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 2.4 pttt -100.91 -49.97 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 55.43 110.975 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.42 -12.46 37.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 61.210000000000001 110.844 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -80.67 127.55 32.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 60.409999999999997 110.954 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -70.21 69.22 0.35 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.251 -0.432 . . . . 62.329999999999998 110.886 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.619 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -46.67 174.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 71.150000000000006 110.834 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.65 156.3 46.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.116 -0.493 . . . . 71.129999999999995 110.921 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 4.6 m95 -48.79 -36.68 17.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 75.409999999999997 110.901 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.4 m -62.77 -32.08 73.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 62.210000000000001 110.832 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.532 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.9 mm100 -73.44 -39.03 65.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 64.019999999999996 110.921 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.619 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -57.5 -54.94 41.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.919 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.844 HG12 HD23 ' A' ' 42' ' ' LEU . 12.2 m -61.31 -31.73 51.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.459 . . . . 64.040000000000006 111.18 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.424 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 1.8 tmm? -64.13 -43.3 95.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 63.299999999999997 110.86 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.82 HD11 HD22 ' A' ' 132' ' ' LEU . 4.4 tp -60.18 -38.99 84.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 45.009999999999998 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.056 HD23 HD13 ' A' ' 42' ' ' LEU . 0.7 OUTLIER -66.77 -48.63 68.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 72.329999999999998 110.909 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.71 -53.54 56.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 53.520000000000003 111.126 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.934 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.4 t80 -53.17 -60.88 2.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 73.030000000000001 110.845 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.117 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -36.52 -58.04 0.73 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 53.229999999999997 111.156 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.36 -27.97 68.62 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.72 -0.753 . . . . 72.439999999999998 112.514 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.667 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.94 -26.13 63.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 111.162 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.934 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.0 mt -83.09 -36.41 24.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 72.340000000000003 110.946 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.771 ' HG3' HG23 ' A' ' 20' ' ' ILE . 43.7 mmm -52.2 107.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 60.0 110.916 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.568 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -86.94 161.34 18.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.329999999999998 110.904 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.729 ' NE2' HD11 ' A' ' 120' ' ' ILE . 56.0 mm-40 -140.05 70.02 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 64.439999999999998 110.948 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.97 70.23 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.806 -0.712 . . . . 74.549999999999997 112.553 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.528 ' HB2' ' CD1' ' A' ' 106' ' ' TYR . 53.4 Cg_endo -69.71 -162.71 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.692 2.261 . . . . 74.329999999999998 112.326 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.695 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.38 -83.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 73.150000000000006 110.944 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.7 ' HE2' ' H ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -152.24 -157.47 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.179 -0.464 . . . . 65.430000000000007 110.883 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -140.82 108.25 5.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 65.310000000000002 111.134 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.621 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.0 p -156.14 -51.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 73.299999999999997 111.165 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.621 ' N ' HG13 ' A' ' 109' ' ' VAL . 7.3 mttt -94.49 78.74 3.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 71.420000000000002 110.863 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.781 ' OE1' HD21 ' A' ' 115' ' ' LEU . 34.2 mm-40 -136.04 122.07 20.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 73.299999999999997 110.946 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.415 ' C ' ' HG2' ' A' ' 113' ' ' ARG . 6.4 mmpt? -83.7 34.08 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.447 . . . . 75.310000000000002 110.919 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 112' ' ' LYS . 15.2 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 75.129999999999995 110.904 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -108.12 -58.53 1.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 73.319999999999993 110.859 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.781 HD21 ' OE1' ' A' ' 111' ' ' GLN . 0.1 OUTLIER -56.63 -13.04 2.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 72.140000000000001 110.935 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.65 -110.69 3.39 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.825 -0.702 . . . . 63.340000000000003 112.47 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.455 HD22 HG11 ' A' ' 121' ' ' VAL . 32.5 t30 -80.66 176.16 10.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 62.119999999999997 110.889 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.711 ' HB3' HD12 ' A' ' 120' ' ' ILE . 4.8 mmp_? -44.38 138.47 3.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.105 -0.498 . . . . 73.340000000000003 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.559 ' HA ' HG22 ' A' ' 122' ' ' THR . 0.5 OUTLIER -76.58 -11.41 13.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 63.409999999999997 111.131 -179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.903 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -66.74 -31.01 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 55.420000000000002 111.081 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.903 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.5 OUTLIER -76.46 -42.11 35.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 73.109999999999999 111.158 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.559 HG22 ' HA ' ' A' ' 119' ' ' VAL . 9.1 t -75.02 -37.59 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 61.439999999999998 111.149 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.5 ptm180 -73.24 -47.98 38.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.218 -0.446 . . . . 73.319999999999993 110.919 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.49 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 30.9 t0 -72.09 -24.85 61.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.5 t -67.59 -51.59 48.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 61.119999999999997 110.823 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.508 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 6.3 t -61.49 -37.81 85.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.222 -0.445 . . . . 74.310000000000002 110.849 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 85.0 mt -75.63 -54.79 6.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 70.540000000000006 110.908 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.872 HD11 HD12 ' A' ' 100' ' ' LEU . 3.9 tt -60.44 -48.4 88.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 62.219999999999999 111.11 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 125' ' ' CYS . 37.0 t -67.59 -33.43 62.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.039999999999999 111.083 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -58.04 -38.09 75.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 64.530000000000001 110.893 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.697 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 4.9 t80 -74.15 -55.86 5.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.434 . . . . 64.120000000000005 110.898 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.117 HD11 ' HB2' ' A' ' 97' ' ' ALA . 9.2 mt -58.66 -54.24 49.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.159 -0.473 . . . . 73.540000000000006 110.884 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.496 ' CE1' ' O ' ' A' ' 9' ' ' HIS . 7.8 t80 -48.26 -47.94 35.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.283 -0.417 . . . . 74.540000000000006 110.926 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.11 -35.5 69.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 64.430000000000007 110.904 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.659 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.73 -45.28 86.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 53.219999999999999 110.917 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.977 HD21 ' CG2' ' A' ' 12' ' ' THR . 1.1 pp -85.17 -25.74 27.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 60.219999999999999 110.917 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.54 ' N ' HD12 ' A' ' 136' ' ' LEU . 11.0 tpp -86.41 24.51 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.238 -0.437 . . . . 74.230000000000004 110.912 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.425 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -74.35 172.64 51.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.774 -0.727 . . . . 72.430000000000007 112.446 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.432 ' CB ' ' HE ' ' A' ' 140' ' ' ARG . 37.6 mtt180 -66.92 -53.29 33.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 72.439999999999998 110.9 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -77.1 -47.6 20.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 63.210000000000001 110.847 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.598 ' CE1' ' HA ' ' A' ' 136' ' ' LEU . 10.9 t-80 -55.82 -62.45 1.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.451 . . . . 71.019999999999996 110.873 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.698 HH21 HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -51.32 -44.7 62.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 75.409999999999997 110.849 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.4 -43.21 67.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 111.161 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 22.2 mtt85 -76.34 -47.6 22.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 75.420000000000002 110.874 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.09 -47.49 6.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 54.329999999999998 110.949 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.852 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.3 OUTLIER -81.15 -34.95 32.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.924 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.33 -16.43 5.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 72.049999999999997 111.134 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.02 25.73 11.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.540000000000006 110.941 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.76 -20.54 45.68 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.747 -0.739 . . . . 53.039999999999999 112.47 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 69.92 -172.66 39.79 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.677 -0.773 . . . . 24.120000000000001 112.434 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.533 ' CD1' HD23 ' A' ' 8' ' ' LEU . 54.2 m95 -37.63 -28.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 110.873 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.2 OUTLIER -68.76 -47.49 66.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.302 -0.408 . . . . 62.310000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -59.3 -32.7 72.83 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.721 -0.752 . . . . 61.310000000000002 112.465 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.863 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 11.9 t80 -66.52 -47.37 73.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.818 0.342 . . . . 71.340000000000003 110.854 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.728 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.7 p -51.68 -43.94 62.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 73.310000000000002 110.937 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.574 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.27 -26.61 42.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 110.829 -179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.408 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 16.8 t80 -66.92 -43.28 83.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 62.020000000000003 110.9 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HB2' HD11 ' A' ' 41' ' ' LEU . 25.6 m-85 -101.07 -3.03 30.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 75.010000000000005 110.871 -179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 63.34 99.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 64.329999999999998 110.936 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.427 ' CG ' ' HD2' ' A' ' 161' ' ' PRO . 2.7 t30 -65.38 140.06 97.59 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.611 0.72 . . . . 55.140000000000001 110.901 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.72 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.643 2.228 . . . . 72.120000000000005 112.385 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.484 HD13 ' HD2' ' A' ' 163' ' ' PRO . 1.3 mm? -67.02 141.36 96.55 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.643 0.735 . . . . 70.120000000000005 110.943 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.484 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.6 Cg_endo -69.78 -51.02 0.41 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.676 2.251 . . . . 71.140000000000001 112.281 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.7 mp -86.98 -173.31 4.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.241 -0.436 . . . . 71.129999999999995 110.946 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.31 -1.116 . . . . 51.149999999999999 110.31 179.928 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.56 0 N-CA-C 110.251 -1.139 . . . . 61.109999999999999 110.251 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 0.08 6.11 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.686 2.257 . . . . 74.319999999999993 112.326 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.723 HD22 ' CZ ' ' A' ' 139' ' ' ARG . 5.8 tt -65.39 115.83 6.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.277 -0.42 . . . . 63.43 110.999 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -57.49 -158.13 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.777 -0.725 . . . . 45.310000000000002 112.516 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.5 p -107.82 134.95 50.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.959 0.409 . . . . 72.540000000000006 110.788 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.436 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 26.1 ptm -90.74 -52.83 4.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 73.329999999999998 110.896 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.667 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -133.8 178.53 6.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 65.510000000000005 111.087 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.9 -32.31 3.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -112.47 -23.63 10.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 62.299999999999997 110.839 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.667 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 59.4 mm-40 -40.98 -40.09 1.33 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 62.409999999999997 110.872 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.04 86.76 9.56 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.547 0.689 . . . . 60.119999999999997 110.908 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.05 3.92 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.665 2.244 . . . . 61.310000000000002 112.321 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.61 HD13 HH21 ' A' ' 142' ' ' ARG . 2.1 mt -66.72 -4.06 8.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 73.230000000000004 110.897 179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -61.45 -77.04 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 72.430000000000007 110.93 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.9 tp10 -51.76 -16.62 0.71 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 60.439999999999998 110.844 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.66 -42.68 77.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.942 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.103 HG21 HD11 ' A' ' 136' ' ' LEU . 53.0 m -78.73 -41.29 31.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.430000000000007 111.165 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.7 tpp85 -61.84 -46.12 90.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.219999999999999 110.925 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.53 -46.12 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 70.329999999999998 110.891 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.15 -52.15 63.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.174 -0.466 . . . . 75.239999999999995 110.924 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.891 ' HB3' HG13 ' A' ' 129' ' ' VAL . 7.7 mp -58.9 -51.57 69.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.891 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.402 ' HA ' HG12 ' A' ' 20' ' ' ILE . 39.4 m -62.09 -33.66 74.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 42.109999999999999 110.874 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -56.8 -47.13 80.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.918 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.757 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.5 t80 -61.51 -42.54 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 64.25 110.974 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.791 HG22 ' SD ' ' A' ' 101' ' ' MET . 8.3 mm -50.44 -45.72 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.081 -0.509 . . . . 53.039999999999999 111.14 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -61.17 -46.5 90.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.902 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.633 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -60.07 -29.33 68.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 62.240000000000002 110.873 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.7 m -85.24 -9.36 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 70.549999999999997 110.887 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -92.08 17.03 10.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 62.43 111.09 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.471 ' HD2' ' CD ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -114.24 112.97 23.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.443 . . . . 73.340000000000003 110.883 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 25' ' ' ARG . 8.0 mt-10 -35.2 149.65 0.1 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.71 0.767 . . . . 74.129999999999995 110.901 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -20.38 35.08 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.622 2.214 . . . . 62.240000000000002 112.429 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -75.66 5.51 6.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 64.019999999999996 110.861 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.5 t -143.0 141.13 18.92 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.672 0.749 . . . . 53.210000000000001 111.104 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 137.33 35.19 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.715 2.277 . . . . 64.439999999999998 112.31 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.541 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -86.38 151.46 53.6 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 121.624 0.726 . . . . 64.420000000000002 110.882 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.471 ' CD ' ' HD2' ' A' ' 25' ' ' ARG . 53.7 Cg_endo -69.79 170.38 16.74 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.64 2.227 . . . . 63.310000000000002 112.323 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 170.19 17.21 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.714 2.276 . . . . 75.230000000000004 112.283 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' HG3' ' CB ' ' A' ' 40' ' ' ALA . 53.4 Cg_endo -69.78 -174.48 0.92 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.713 2.275 . . . . 62.299999999999997 112.32 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.28 -36.54 4.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 54.399999999999999 111.177 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.613 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -133.88 -178.69 5.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 73.209999999999994 110.805 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -62.0 -53.52 46.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 111.145 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.848 ' O ' HD22 ' A' ' 42' ' ' LEU . 1.7 pm0 -63.54 -27.59 69.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.209 -0.451 . . . . 74.150000000000006 110.876 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.613 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.1 -37.02 69.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 74.400000000000006 111.058 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.451 ' CB ' ' HG3' ' A' ' 34' ' ' PRO . . . -68.12 -41.61 81.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 62.130000000000003 111.12 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.741 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -55.92 -54.12 48.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 62.329999999999998 110.946 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.848 HD22 ' O ' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -50.77 -49.46 58.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 50.119999999999997 110.864 179.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.43 -26.83 21.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.89 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.5 OUTLIER -90.14 -44.51 9.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 63.409999999999997 110.922 -179.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.684 HG11 ' HD2' ' A' ' 158' ' ' PHE . 33.4 m -92.89 -54.33 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.496 . . . . 71.040000000000006 111.103 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.757 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.03 -32.15 14.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 60.039999999999999 111.184 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.61 -32.37 73.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 75.25 110.879 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.522 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -78.46 -30.34 47.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.25 110.963 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.625 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.9 mm -64.62 -35.31 74.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.097 -0.501 . . . . 65.519999999999996 111.141 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.698 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.9 mt-30 -80.87 -62.22 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.549999999999997 110.924 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -45.78 -20.87 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.886 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.579 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -97.6 -43.03 7.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 74.239999999999995 110.867 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.635 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.9 m-70 -100.87 -44.21 5.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.815 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.698 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.97 -28.92 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.248 -0.433 . . . . 74.150000000000006 110.902 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.46 -44.83 35.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.227 -0.442 . . . . 75.030000000000001 110.917 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -88.29 -41.38 12.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 64.409999999999997 110.96 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.635 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.0 m-30 -53.39 -61.82 2.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 72.340000000000003 110.831 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.26 -41.94 76.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 53.43 110.817 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 t -51.47 -40.58 59.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 54.140000000000001 110.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.589 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.43 -41.34 16.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 72.25 110.827 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -41.94 -44.43 3.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 63.329999999999998 110.977 -179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.491 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 11.4 pt-20 -87.02 33.46 0.67 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.16 -0.473 . . . . 64.319999999999993 110.87 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 60' ' ' PHE . 32.7 t -109.76 -55.37 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 73.230000000000004 110.839 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.453 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 14.9 mmm180 -115.82 -11.22 11.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 62.130000000000003 110.864 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.26 11.11 84.35 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.749 -0.739 . . . . 61.420000000000002 112.523 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.941 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.95 31.86 0.43 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 74.340000000000003 110.84 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.75 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.52 -34.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 74.5 110.811 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.604 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.6 tp -77.74 -50.95 11.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 60.329999999999998 110.887 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 63.8 mt-10 -50.31 -34.45 23.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 55.229999999999997 110.831 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.941 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -77.27 -37.01 53.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 110.927 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.637 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.97 -45.37 95.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.239999999999995 111.173 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.676 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.0 ptpt -72.63 -44.15 62.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 73.349999999999994 110.886 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.18 -50.0 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 74.439999999999998 110.955 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.796 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 11.2 mmm -57.59 -55.17 38.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 73.319999999999993 110.865 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.779 ' HB1' ' CD1' ' A' ' 135' ' ' LEU . . . -51.44 -21.93 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.256 -0.429 . . . . 41.409999999999997 111.134 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -82.48 -29.77 30.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 74.439999999999998 110.933 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.895 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.8 ptpt -80.83 -48.38 12.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 75.450000000000003 110.847 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.974 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.89 -62.84 1.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 43.509999999999998 110.872 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.974 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -82.32 151.0 26.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 62.439999999999998 110.975 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.42 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -159.72 -176.3 5.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.310000000000002 110.885 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.566 ' HA ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -101.35 -43.87 5.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 71.540000000000006 110.892 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.411 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.71 -14.21 30.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 53.109999999999999 110.826 179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.612 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -88.17 127.45 35.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 74.109999999999999 110.96 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -61.88 75.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.318 -0.401 . . . . 64.5 110.83 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.751 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -58.91 123.4 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 65.25 110.91 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.9 t -89.17 173.99 8.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 70.310000000000002 110.847 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 1.075 ' CZ3' HD12 ' A' ' 90' ' ' LEU . 11.7 m95 -65.79 -35.05 79.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 64.230000000000004 110.922 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.6 t -55.84 -33.26 64.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 72.129999999999995 110.838 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -72.64 -44.19 62.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 75.120000000000005 110.908 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.075 HD12 ' CZ3' ' A' ' 87' ' ' TRP . 6.9 mt -53.25 -56.36 17.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.447 . . . . 71.230000000000004 110.931 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.817 HG12 HD11 ' A' ' 42' ' ' LEU . 17.1 m -61.13 -31.07 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 63.340000000000003 111.175 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.625 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.5 tmm? -64.77 -42.42 95.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.887 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.491 ' CD1' ' HG ' ' A' ' 79' ' ' LEU . 7.1 mt -58.06 -45.23 87.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.142 -0.481 . . . . 74.319999999999993 110.933 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.607 ' O ' ' CE2' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -59.92 -40.54 89.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.448 . . . . 72.519999999999996 110.972 179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.569 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -64.02 -58.5 6.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 71.099999999999994 111.089 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.925 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -52.64 -59.84 3.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.340000000000003 110.838 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.015 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -37.38 -50.37 1.05 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 75.400000000000006 111.116 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.54 -27.69 73.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.812 -0.708 . . . . 65.140000000000001 112.497 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -69.6 -25.79 64.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 74.430000000000007 111.171 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.925 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -84.05 -48.62 9.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 74.319999999999993 110.956 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.791 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.17 118.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 54.439999999999998 110.901 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.511 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -97.0 161.21 13.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.261 -0.427 . . . . 54.420000000000002 110.971 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.49 ' OE1' ' CG ' ' A' ' 101' ' ' MET . 2.3 mm100 -129.39 106.41 8.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 72.25 110.894 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.504 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -151.92 49.51 0.53 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.765 -0.731 . . . . 40.210000000000001 112.465 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.504 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.2 Cg_endo -69.78 -162.94 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.697 2.265 . . . . 74.439999999999998 112.322 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.529 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -124.36 -13.57 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 74.409999999999997 110.859 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.438 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -39.13 95.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 71.099999999999994 110.863 179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.487 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -100.15 -151.52 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 72.099999999999994 111.106 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.848 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.37 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.272 -0.422 . . . . 71.120000000000005 111.117 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.848 ' N ' HG22 ' A' ' 109' ' ' VAL . 1.2 mtpt -68.44 90.79 0.38 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.19 -0.459 . . . . 64.450000000000003 110.919 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.487 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 21.3 mm-40 -143.09 119.16 10.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.441 . . . . 70.450000000000003 110.931 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.76 65.72 0.72 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 75.0 110.913 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -119.07 173.84 6.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.299999999999997 110.922 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.18 -55.45 0.98 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.242 -0.435 . . . . 71.0 110.892 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.88 -65.25 0.65 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 61.009999999999998 110.952 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 138.37 -45.07 1.07 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.767 -0.73 . . . . 40.200000000000003 112.517 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -154.8 116.5 4.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 60.200000000000003 110.881 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.778 ' HA ' HG13 ' A' ' 121' ' ' VAL . 36.8 ptt85 -153.47 15.24 0.51 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 74.439999999999998 110.892 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.4 t -78.9 -68.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 61.520000000000003 111.158 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.908 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -85.25 -31.08 6.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 75.109999999999999 111.112 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.908 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -64.54 -40.66 89.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.435 . . . . 63.119999999999997 111.144 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.56 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.8 t -67.69 -48.46 66.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.149 -0.478 . . . . 55.43 111.163 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.555 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -66.09 -48.08 72.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.409999999999997 110.866 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.6 ' HA ' HD21 ' A' ' 127' ' ' LEU . 68.2 m-20 -68.15 -28.99 67.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 73.129999999999995 110.884 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.743 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.6 t -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 60.240000000000002 110.885 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.468 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 12.8 t -65.99 -42.07 90.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.201 -0.454 . . . . 73.219999999999999 110.881 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.965 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.8 pp -75.31 -54.68 6.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.146 -0.479 . . . . 64.340000000000003 110.905 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.965 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.41 -48.0 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 111.108 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.891 HG13 ' HB3' ' A' ' 16' ' ' LEU . 29.4 t -72.61 -31.91 39.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.182 -0.463 . . . . 51.329999999999998 111.124 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.468 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.87 -47.73 79.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 63.439999999999998 110.846 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.676 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.6 t80 -64.41 -55.86 18.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.030000000000001 110.873 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.015 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 5.0 mp -64.35 -26.46 68.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.075 -0.512 . . . . 73.510000000000005 110.959 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.514 ' CE2' ' HB2' ' A' ' 13' ' ' ARG . 40.0 t80 -76.38 -37.24 57.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 73.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -75.68 -41.49 53.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 110.855 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.779 ' CD1' ' HB1' ' A' ' 75' ' ' ALA . 2.0 mt -57.82 -45.4 86.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.191 -0.459 . . . . 71.239999999999995 110.974 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.103 HD11 HG21 ' A' ' 12' ' ' THR . 2.0 pp -82.31 -23.0 35.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 70.230000000000004 110.912 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.472 ' CB ' ' O ' ' A' ' 133' ' ' TYR . 11.5 tpp -96.92 24.19 6.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 72.319999999999993 110.899 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -78.53 157.41 44.1 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.705 -0.759 . . . . 53.310000000000002 112.458 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.723 ' CZ ' HD22 ' A' ' -3' ' ' LEU . 3.9 mmt180 -50.89 -54.74 21.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.782 0.325 . . . . 62.020000000000003 110.892 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -44.77 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 62.43 110.81 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.566 ' CD2' ' HA ' ' A' ' 81' ' ' LYS . 31.7 m80 -58.53 -61.79 2.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 62.109999999999999 110.848 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.723 ' NH1' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -50.41 -52.55 36.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 61.210000000000001 110.879 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.7 -36.76 16.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 53.0 111.094 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 12.5 tpt85 -77.22 -49.16 15.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.540000000000006 110.827 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.85 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -47.37 -43.17 23.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.428 . . . . 73.030000000000001 110.885 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.809 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.65 -30.22 32.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 70.340000000000003 110.928 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.41 -15.39 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 111.1 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.665 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.9 26.6 10.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 110.909 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.04 0.93 61.55 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.737 -0.744 . . . . 74.030000000000001 112.459 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.09 -171.64 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.713 -0.756 . . . . 34.130000000000003 112.452 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.404 ' C ' ' O ' ' A' ' 150' ' ' GLY . 23.7 m95 -37.75 -33.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.714 0.292 . . . . 64.549999999999997 110.894 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 150' ' ' GLY . 6.8 t70 -62.2 -47.53 84.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 72.099999999999994 110.922 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -62.12 -31.17 77.9 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.67 -0.776 . . . . 51.100000000000001 112.526 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.639 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.2 t80 -67.55 -53.01 32.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.906 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.741 ' HA ' HD23 ' A' ' 41' ' ' LEU . 3.8 p -51.63 -39.02 57.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.149 -0.478 . . . . 74.530000000000001 110.855 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.556 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.99 42.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 110.881 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -68.86 -44.28 73.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.939 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.684 ' HD2' HG11 ' A' ' 45' ' ' VAL . 3.9 m-85 -95.78 1.91 53.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 63.350000000000001 110.879 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 41.15 82.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.903 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.575 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.27 167.48 0.19 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.532 0.682 . . . . 75.140000000000001 110.933 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.6 Cg_endo -69.73 -50.08 0.5 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.708 2.272 . . . . 72.209999999999994 112.297 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.405 ' O ' ' ND2' ' A' ' 160' ' ' ASN . 0.7 OUTLIER -105.72 118.49 55.25 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.608 0.718 . . . . 60.329999999999998 110.91 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.76 -38.25 8.04 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.703 2.268 . . . . 65.420000000000002 112.305 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -76.38 177.01 7.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 74.310000000000002 110.887 -179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.264 -1.134 . . . . 51.310000000000002 110.264 179.946 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.554 0 N-CA-C 110.259 -1.136 . . . . 25.350000000000001 110.259 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.555 ' O ' HD22 ' A' ' -3' ' ' LEU . 53.6 Cg_endo -69.74 -20.16 35.29 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.666 2.244 . . . . 64.420000000000002 112.344 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.555 HD22 ' O ' ' A' ' -4' ' ' PRO . 2.6 mm? -122.96 -14.83 7.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 74.239999999999995 110.886 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 115.32 -173.87 14.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.695 -0.764 . . . . 70.219999999999999 112.446 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.1 t -91.04 118.36 30.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 72.510000000000005 110.887 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.1 ttt -90.89 -46.15 8.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 73.310000000000002 110.886 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.7 176.71 6.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 72.540000000000006 111.121 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.4 -39.48 16.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.426 . . . . 72.230000000000004 110.921 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.9 m -81.38 14.9 2.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 73.329999999999998 110.833 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -84.18 63.17 7.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 61.009999999999998 110.957 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.97 159.96 1.68 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.581 0.705 . . . . 70.129999999999995 110.907 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -91.03 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.727 2.285 . . . . 71.310000000000002 112.407 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.925 HD12 ' NE1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -113.36 5.77 16.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.164 -0.471 . . . . 61.109999999999999 110.918 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.491 ' N ' HD23 ' A' ' 8' ' ' LEU . 40.2 t-80 -43.1 -79.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.881 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -62.19 -15.24 45.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.895 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -72.67 -38.2 67.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.475 . . . . 73.209999999999994 110.924 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.646 ' CG2' HD11 ' A' ' 136' ' ' LEU . 89.5 m -74.85 -53.22 9.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.152 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 9.9 tpt180 -50.8 -52.44 41.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 53.140000000000001 110.919 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.487 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.84 -45.61 93.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 74.129999999999995 110.841 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.829 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.34 -45.85 87.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.92 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.842 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.3 mp -66.5 -48.69 69.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 73.430000000000007 110.938 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.459 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.7 OUTLIER -60.93 -38.22 85.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.140000000000001 110.842 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.553 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -56.28 -47.74 78.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.496 . . . . 64.239999999999995 110.864 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.764 ' CE1' HG21 ' A' ' 46' ' ' THR . 82.3 t80 -57.34 -43.06 83.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 54.340000000000003 110.942 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.885 HG22 ' SD ' ' A' ' 101' ' ' MET . 5.1 mm -51.13 -45.19 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 60.32 111.143 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.03 -44.85 95.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.821 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -55.95 -30.29 61.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 73.239999999999995 110.826 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.07 -13.47 41.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 55.409999999999997 110.9 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.513 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . -81.85 17.14 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 111.044 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' CA ' ' NE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -112.59 112.75 24.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 72.200000000000003 110.908 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -39.07 154.62 0.15 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.66 0.743 . . . . 65.010000000000005 110.877 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 -8.43 23.58 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.699 2.266 . . . . 62.43 112.38 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.12 5.63 49.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 72.450000000000003 110.817 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.83 140.8 16.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 75.439999999999998 111.096 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 137.84 36.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.717 2.278 . . . . 74.510000000000005 112.33 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -74.84 156.84 86.24 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.694 0.759 . . . . 71.030000000000001 110.892 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 170.11 17.29 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.699 2.266 . . . . 73.530000000000001 112.386 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 170.27 16.95 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.632 2.221 . . . . 71.530000000000001 112.341 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -167.58 0.24 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.633 2.222 . . . . 61.310000000000002 112.358 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.553 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -131.58 -53.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.281 -0.418 . . . . 61.350000000000001 111.078 -179.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.524 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.9 m -124.05 -176.25 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.275 -0.421 . . . . 45.5 110.875 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.609 HG11 ' CA ' ' A' ' 165' ' ' GLY . 1.6 t -64.71 -48.98 82.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 72.209999999999994 111.077 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.614 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -65.9 -29.26 69.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 74.140000000000001 110.901 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.524 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.78 -29.02 62.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.148 -0.478 . . . . 61.450000000000003 111.097 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.514 ' O ' ' CD ' ' A' ' 43' ' ' ARG . . . -75.18 -37.7 61.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 71.409999999999997 111.125 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.944 HD13 ' CZ ' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -67.36 -44.03 80.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 71.239999999999995 110.901 -179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.003 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -57.52 -57.34 13.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 64.209999999999994 110.932 179.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' CD ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.54 -25.31 10.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.459 . . . . 73.430000000000007 110.818 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.3 OUTLIER -85.2 -44.88 12.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.303 -0.408 . . . . 74.239999999999995 110.847 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.687 HG23 ' N ' ' A' ' 46' ' ' THR . 21.6 m -91.82 -54.34 7.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 72.209999999999994 111.09 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -49.4 -33.57 14.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 74.5 111.112 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.573 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.19 -32.27 69.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.902 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.573 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.7 -31.73 41.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 51.340000000000003 110.896 -179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.575 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.5 mm -63.62 -32.23 56.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.477 . . . . 73.299999999999997 111.194 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.6 mt-30 -81.35 -60.88 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.13 -0.486 . . . . 55.149999999999999 110.883 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.01 -19.95 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 70.530000000000001 110.924 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 19.5 pt-20 -96.55 -41.75 8.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 75.329999999999998 110.869 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.623 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 63.5 m-70 -103.61 -44.4 5.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.481 . . . . 72.329999999999998 110.842 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.9 -24.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 70.109999999999999 110.968 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -46.7 -32.14 3.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 70.140000000000001 110.908 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.432 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 11.1 m-85 -103.3 -40.31 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 63.420000000000002 110.896 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.1 m-85 -53.05 -56.81 13.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.889 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.5 t -49.48 -44.29 45.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 62.409999999999997 110.808 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.6 t -51.78 -37.8 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 72.319999999999993 110.792 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 91.8 m-85 -79.45 -35.86 39.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.877 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 t -49.62 -25.34 2.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.139 -0.482 . . . . 71.439999999999998 110.847 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -122.16 33.23 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.465 . . . . 61.450000000000003 110.932 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 54.5 m -118.13 -68.4 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 73.439999999999998 110.828 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.451 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 8.0 mpt_? -96.18 -21.09 18.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 63.140000000000001 110.832 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.22 85.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.661 -0.781 . . . . 55.329999999999998 112.457 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -83.37 31.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.846 0.355 . . . . 54.439999999999998 110.814 -179.811 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.81 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.55 -32.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.925 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.3 tp -74.83 -51.61 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 71.120000000000005 110.902 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.508 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.3 OUTLIER -51.75 -33.49 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.140000000000001 110.925 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.2 mt -75.89 -35.72 59.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 54.549999999999997 110.923 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.96 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -61.85 -46.09 97.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.11 -0.496 . . . . 44.32 111.156 179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.692 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.5 ptpt -72.39 -43.48 63.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.885 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.07 -48.55 73.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.943 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.703 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 16.2 mmm -56.54 -57.63 11.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 64.129999999999995 110.901 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -53.03 -18.77 2.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 62.020000000000003 111.096 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.34 -29.4 31.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 110.853 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.853 ' HG3' HD23 ' A' ' 78' ' ' LEU . 6.0 ptpt -86.21 -49.37 7.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.233 -0.439 . . . . 43.310000000000002 110.873 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.86 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.45 -54.77 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 72.230000000000004 110.896 179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.86 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -94.01 157.09 16.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.288 -0.415 . . . . 61.399999999999999 110.936 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.584 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -172.2 -160.74 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 62.409999999999997 110.84 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -101.27 -66.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 60.350000000000001 110.917 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.485 ' OD2' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -72.9 -21.02 60.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 43.43 110.868 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.734 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -66.3 133.57 50.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 70.120000000000005 110.891 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -74.82 56.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 73.140000000000001 110.839 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.81 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.68 126.96 5.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 71.530000000000001 110.853 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 21.0 p -102.63 160.03 14.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.111 -0.495 . . . . 73.439999999999998 110.868 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 1.073 ' CE3' HD12 ' A' ' 90' ' ' LEU . 16.5 m95 -49.26 -28.64 4.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.924 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 92' ' ' MET . 72.7 m -62.79 -33.95 76.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.244 -0.435 . . . . 72.109999999999999 110.838 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.506 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -74.97 -46.25 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.129999999999995 110.856 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.073 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.4 mt -48.77 -55.43 11.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 110.887 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.785 HG11 ' CE1' ' A' ' 154' ' ' PHE . 31.3 m -65.94 -31.2 52.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 111.092 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.575 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.9 tmm? -61.88 -46.98 87.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 63.240000000000002 110.836 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.835 HD11 ' HB2' ' A' ' 75' ' ' ALA . 15.7 tp -58.45 -41.71 85.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.293 -0.412 . . . . 74.420000000000002 110.874 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.003 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.12 -46.33 82.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.231 -0.44 . . . . 75.109999999999999 110.984 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.789 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -57.28 -58.13 9.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.121 -0.49 . . . . 75.239999999999995 111.096 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 1.004 ' CE2' HD11 ' A' ' 100' ' ' LEU . 70.9 t80 -49.22 -59.57 3.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.446 . . . . 75.230000000000004 110.83 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.025 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.33 -48.87 1.37 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.150000000000006 111.102 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.64 -26.93 73.26 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.721 -0.752 . . . . 71.230000000000004 112.464 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.633 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.94 -26.61 62.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.823 0.344 . . . . 61.409999999999997 111.162 -179.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.004 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.3 mt -81.34 -30.69 33.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 61.329999999999998 110.892 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.885 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 62.229999999999997 110.898 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.503 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -69.24 146.19 52.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 74.200000000000003 110.847 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.476 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 49.0 mm-40 -147.37 82.04 1.53 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 54.509999999999998 110.867 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -177.93 58.57 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.757 -0.735 . . . . 43.25 112.472 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.442 ' HB3' ' CG2' ' A' ' 120' ' ' ILE . 53.9 Cg_endo -69.74 -163.13 0.1 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.717 2.278 . . . . 51.119999999999997 112.322 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.617 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.36 -29.57 3.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 65.209999999999994 110.921 -179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.541 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 15.3 mmt -36.1 92.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.501 . . . . 53.299999999999997 110.885 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.518 ' O ' ' NE2' ' A' ' 111' ' ' GLN . . . -106.84 19.4 20.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.347 -0.388 . . . . 73.5 111.087 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.622 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.3 p -91.08 -52.07 10.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 51.140000000000001 111.11 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.622 ' N ' HG13 ' A' ' 109' ' ' VAL . 1.3 mtpt -116.15 76.91 1.05 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.226 -0.443 . . . . 64.310000000000002 110.934 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 108' ' ' ALA . 0.0 OUTLIER -115.28 134.46 55.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 54.310000000000002 110.891 -179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -163.24 -177.27 5.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 54.329999999999998 110.921 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.9 43.36 2.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.099999999999994 110.888 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -133.74 -65.2 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 64.400000000000006 110.894 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.606 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -60.81 -11.91 9.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 75.25 110.872 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.403 ' O ' ' O ' ' A' ' 117' ' ' ASN . . . 61.52 150.89 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.732 -0.747 . . . . 62.109999999999999 112.503 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.474 HD22 HG11 ' A' ' 121' ' ' VAL . 0.6 OUTLIER -47.84 -98.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.82 0.343 . . . . 63.109999999999999 110.863 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.76 ' HA ' HG13 ' A' ' 121' ' ' VAL . 26.8 mtt180 62.91 5.9 1.99 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 71.519999999999996 110.877 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.774 HG13 ' H ' ' A' ' 120' ' ' ILE . 1.3 p -76.38 -66.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 111.143 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.774 ' H ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -84.77 -34.18 8.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 111.125 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.76 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.51 -43.34 94.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 73.239999999999995 111.143 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.509 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.8 t -64.42 -40.26 95.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 72.25 111.114 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.415 ' N ' HG23 ' A' ' 122' ' ' THR . 3.1 ptm180 -76.39 -34.38 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 71.109999999999999 110.899 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -77.57 -32.22 53.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 72.040000000000006 110.874 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.687 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.4 p -69.4 -46.74 66.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 71.549999999999997 110.895 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.506 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.6 t -63.26 -40.45 97.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 73.239999999999995 110.862 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.09 -54.6 6.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 64.25 110.876 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.96 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.3 tt -59.16 -47.53 89.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 70.409999999999997 111.147 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.842 HG13 ' HB3' ' A' ' 16' ' ' LEU . 47.2 t -70.12 -32.5 51.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 74.400000000000006 111.128 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.506 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.1 t30 -56.34 -40.58 74.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.877 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.692 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.8 t80 -70.61 -55.52 8.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 70.439999999999998 110.879 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.025 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.5 mt -59.38 -55.06 39.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 64.400000000000006 110.913 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.599 ' CE1' ' HG3' ' A' ' 137' ' ' MET . 60.0 t80 -42.24 -55.17 3.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.171 -0.468 . . . . 60.149999999999999 110.938 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.451 ' ND2' ' C ' ' A' ' 134' ' ' ASN . 0.4 OUTLIER -68.61 -27.17 65.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.824 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.735 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.72 -43.84 76.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 110.964 179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.3 pt? -96.16 -27.76 14.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 73.040000000000006 110.929 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 133' ' ' TYR . 24.7 mmt -75.99 6.83 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 73.530000000000001 110.92 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -73.18 152.57 47.04 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.746 -0.74 . . . . 63.049999999999997 112.492 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 3.4 mmp_? -49.46 -43.15 44.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 72.420000000000002 110.877 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 141' ' ' HIS . 1.6 tpp85 -78.48 -58.98 2.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.473 . . . . 64.310000000000002 110.818 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.584 ' CD2' ' O ' ' A' ' 80' ' ' SER . 45.9 m80 -55.54 -59.66 4.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.895 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.518 ' NH2' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.77 -48.49 69.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.274 -0.421 . . . . 74.420000000000002 110.859 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.646 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.21 -46.45 45.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 61.009999999999998 111.096 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.452 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 67.3 mtp85 -76.14 -35.43 59.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.819 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.812 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -52.13 -45.81 65.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 71.219999999999999 110.937 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.793 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.77 -35.21 29.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.145 -0.48 . . . . 64.420000000000002 110.851 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.25 -15.41 3.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 74.239999999999995 111.119 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.677 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.99 24.72 12.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 42.210000000000001 110.917 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.79 -14.3 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 62.240000000000002 112.471 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.449 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 62.29 -174.45 7.69 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.768 -0.73 . . . . 54.049999999999997 112.427 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.925 ' NE1' HD12 ' A' ' 8' ' ' LEU . 56.4 m95 -37.27 -37.59 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.771 0.32 . . . . 75.230000000000004 110.911 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.17 -47.44 85.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 62.119999999999997 110.792 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -61.12 -28.86 69.68 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 75.019999999999996 112.507 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.944 ' CZ ' HD13 ' A' ' 41' ' ' LEU . 5.8 t80 -68.45 -58.66 4.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.833 0.349 . . . . 72.109999999999999 110.905 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.722 ' HA ' HD12 ' A' ' 41' ' ' LEU . 3.9 m -51.22 -40.58 59.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 110.884 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.06 -24.27 40.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 64.150000000000006 110.902 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.54 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 3.7 t80 -76.14 -41.82 48.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 110.889 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.692 ' HB2' HD11 ' A' ' 41' ' ' LEU . 16.4 m-85 -100.64 25.09 8.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 74.439999999999998 110.823 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? 39.83 88.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.128 -0.487 . . . . 71.319999999999993 110.903 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.433 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 4.3 t-20 -65.57 143.15 98.56 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 73.510000000000005 110.918 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.407 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -46.01 1.35 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.672 2.248 . . . . 74.219999999999999 112.361 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.468 HD22 ' CB ' ' A' ' 40' ' ' ALA . 4.5 mp -64.2 161.03 44.18 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.638 0.732 . . . . 73.129999999999995 110.907 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.589 ' HG2' HD22 ' A' ' 164' ' ' LEU . 53.9 Cg_endo -69.78 -50.52 0.46 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.639 2.226 . . . . 54.240000000000002 112.415 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.589 HD22 ' HG2' ' A' ' 163' ' ' PRO . 2.3 mm? -51.47 -174.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 110.95 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.609 ' CA ' HG11 ' A' ' 37' ' ' VAL . . . . . . . . 0 C--N 1.335 0.522 0 N-CA-C 110.287 -1.125 . . . . 73.0 110.287 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 N-CA-C 110.28 -1.128 . . . . 71.310000000000002 110.28 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -38.31 8.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.724 2.282 . . . . 62.100000000000001 112.304 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 0' ' ' SER . 9.5 mt -100.44 -64.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.329999999999998 110.855 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.445 ' C ' ' O ' ' A' ' -3' ' ' LEU . . . 34.53 -93.27 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.819 -0.705 . . . . 72.219999999999999 112.391 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' -3' ' ' LEU . 90.0 p -144.35 105.63 4.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 75.230000000000004 110.906 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 tpt -56.67 -35.64 68.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 64.140000000000001 110.902 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.15 171.69 17.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 54.329999999999998 111.086 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -74.15 3.7 6.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 110.834 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 6' ' ' ASP . 14.8 t -95.17 -8.1 37.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.540000000000006 110.848 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' SER . 28.2 mm-40 -36.48 -31.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 72.129999999999995 110.889 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.4 OUTLIER -105.46 91.04 4.47 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.574 0.702 . . . . 64.019999999999996 110.899 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.476 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.1 Cg_endo -69.76 -2.13 9.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.69 2.26 . . . . 71.140000000000001 112.339 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.464 HD22 HH21 ' A' ' 142' ' ' ARG . 0.3 OUTLIER -112.8 -16.47 12.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.244 -0.435 . . . . 71.230000000000004 110.936 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.541 ' CE1' ' OH ' ' A' ' 133' ' ' TYR . 5.6 t60 -63.86 -76.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.172 -0.467 . . . . 54.409999999999997 110.851 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' CD ' ' O ' ' A' ' 10' ' ' GLU . 15.1 tm-20 -57.22 -12.71 2.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 73.319999999999993 110.917 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 58.0 mtt180 -74.85 -36.94 62.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 60.210000000000001 110.874 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.91 HG21 HD11 ' A' ' 136' ' ' LEU . 20.2 m -77.84 -52.41 8.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.151 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.5 tpt180 -51.96 -48.7 64.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.86 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.537 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -63.17 -47.37 82.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 110.891 -179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -57.61 -52.45 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.240000000000002 110.954 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.788 ' HB3' HG13 ' A' ' 129' ' ' VAL . 2.5 mp -58.09 -51.46 69.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.119 -0.491 . . . . 75.519999999999996 110.937 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 82.4 p -60.96 -37.46 82.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.882 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -56.05 -46.05 79.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.123 -0.49 . . . . 72.430000000000007 110.878 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.632 ' CE1' HG21 ' A' ' 46' ' ' THR . 67.7 t80 -60.44 -42.61 96.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 71.329999999999998 110.927 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.886 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.4 mm -50.85 -43.95 25.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.114 -0.494 . . . . 71.099999999999994 111.149 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.81 -48.38 79.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.329999999999998 110.911 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.639 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.98 -32.73 64.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 72.010000000000005 110.868 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.11 -8.64 58.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.901 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.6 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -83.88 17.17 2.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 70.349999999999994 111.075 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 47.6 mmt-85 -111.9 112.66 24.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 73.030000000000001 110.922 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -37.68 155.6 0.1 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.62 0.724 . . . . 74.040000000000006 110.902 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -10.76 29.34 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.621 2.214 . . . . 63.219999999999999 112.389 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -90.42 5.57 46.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.254 -0.43 . . . . 75.310000000000002 110.864 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.54 141.18 18.48 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.52 0.676 . . . . 72.200000000000003 111.185 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 137.09 34.82 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.656 2.237 . . . . 64.129999999999995 112.37 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -79.88 157.62 73.8 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 70.239999999999995 110.868 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 169.29 19.27 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.721 2.281 . . . . 60.210000000000001 112.336 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 170.0 17.58 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.696 2.264 . . . . 72.530000000000001 112.358 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.09 39.61 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.797 2.331 . . . . 62.140000000000001 112.267 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -97.85 -44.58 6.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 74.519999999999996 111.18 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.611 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 70.3 m -137.93 -177.8 4.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 72.140000000000001 110.888 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.6 t -60.95 -49.26 85.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 51.43 111.145 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.739 ' CG ' HD22 ' A' ' 15' ' ' LEU . 21.0 pt-20 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 73.530000000000001 110.908 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.611 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.5 -36.19 71.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 74.049999999999997 111.121 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.6 -36.42 80.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 61.140000000000001 111.157 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.816 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -60.25 -52.5 65.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.214 -0.448 . . . . 71.120000000000005 110.921 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.024 HD11 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -51.88 -52.59 48.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 61.32 110.932 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -54.47 -26.08 29.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.873 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.431 ' C ' ' HG3' ' A' ' 47' ' ' ARG . 0.3 OUTLIER -87.24 -47.15 9.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 70.5 110.915 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.762 HG11 ' CD2' ' A' ' 158' ' ' PHE . 27.4 m -91.87 -53.63 8.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.473 . . . . 71.239999999999995 111.17 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.733 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -32.25 11.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.173 -0.467 . . . . 75.319999999999993 111.161 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.61 -31.42 71.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.439 . . . . 72.329999999999998 110.903 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.568 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.53 -32.99 36.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.030000000000001 110.86 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.511 HD13 ' HG3' ' A' ' 48' ' ' GLN . 8.9 mm -63.64 -32.92 58.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 75.5 111.171 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -80.94 -61.32 2.0 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 62.240000000000002 110.883 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.44 -19.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 73.319999999999993 110.895 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.492 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.1 pt-20 -96.91 -41.23 8.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 75.349999999999994 110.849 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.605 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.6 m-70 -103.64 -44.78 5.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.908 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.5 -24.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 73.010000000000005 110.932 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -47.1 -32.41 4.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.434 . . . . 72.310000000000002 110.901 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -103.27 -39.04 6.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 61.130000000000003 110.868 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.605 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.6 m-85 -53.35 -52.48 59.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 72.099999999999994 110.832 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.0 t -49.51 -45.43 47.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 72.530000000000001 110.842 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -52.45 -40.88 62.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.475 . . . . 75.409999999999997 110.81 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -76.13 -42.01 48.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 62.049999999999997 110.818 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 10.9 m -49.25 -26.66 3.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.199 -0.455 . . . . 61.200000000000003 110.886 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -122.41 32.46 5.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 61.219999999999999 110.921 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 46.0 t -118.39 -68.58 0.91 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 70.549999999999997 110.822 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.587 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -93.86 -33.48 13.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 63.049999999999997 110.832 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 93.88 6.47 62.0 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.714 -0.755 . . . . 64.310000000000002 112.514 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.505 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.29 31.46 0.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.847 0.356 . . . . 74.319999999999993 110.867 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.784 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.51 -35.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 72.450000000000003 110.936 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.7 tp -79.19 -51.72 9.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.452 . . . . 72.439999999999998 110.871 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 56.5 mm-40 -51.71 -32.16 29.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 63.409999999999997 110.91 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 70' ' ' LEU . 1.1 mt -77.08 -38.67 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.835 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.902 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.24 -46.27 92.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.276 -0.42 . . . . 72.439999999999998 111.039 179.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.699 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.9 ptpt -72.78 -43.39 62.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.135 -0.484 . . . . 73.540000000000006 110.86 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.86 -48.02 73.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 74.349999999999994 110.876 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.634 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.2 mmm -57.38 -56.87 16.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 71.109999999999999 110.865 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.875 ' HB2' ' CD1' ' A' ' 93' ' ' LEU . . . -52.64 -19.24 2.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.266 -0.424 . . . . 52.219999999999999 111.097 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -78.59 -38.15 40.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 70.019999999999996 110.889 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.868 ' HG3' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -75.55 -48.22 23.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 55.009999999999998 110.929 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.928 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.5 -63.41 1.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.229 -0.441 . . . . 75.409999999999997 110.921 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.928 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -84.37 159.53 20.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.224 -0.444 . . . . 72.319999999999993 110.9 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.468 ' O ' ' CE1' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -168.15 -165.45 0.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.471 . . . . 64.340000000000003 110.838 -179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HB2' ' CZ ' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.77 -48.23 4.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 64.400000000000006 110.887 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -94.27 -6.39 44.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.243 -0.435 . . . . 70.299999999999997 110.85 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -86.4 127.74 34.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.903 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -67.94 71.11 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.19 -0.459 . . . . 55.399999999999999 110.877 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.891 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -50.5 110.64 0.43 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 74.430000000000007 110.826 -179.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 31.3 t -79.44 156.87 27.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.495 . . . . 62.119999999999997 110.824 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.721 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.4 m95 -49.25 -29.64 6.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 74.340000000000003 110.92 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.1 m -66.57 -31.33 71.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.275 -0.421 . . . . 74.239999999999995 110.9 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.0 mm100 -74.66 -39.89 61.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.430000000000007 110.948 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.891 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.9 mm? -55.41 -55.54 30.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.934 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.75 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -63.46 -31.88 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 73.530000000000001 111.128 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.61 -44.02 97.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 65.310000000000002 110.836 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.875 ' CD1' ' HB2' ' A' ' 75' ' ' ALA . 23.3 tp -61.74 -39.03 90.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 74.430000000000007 110.971 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.717 HD13 HD13 ' A' ' 42' ' ' LEU . 9.9 mt -64.88 -45.72 84.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 73.040000000000006 110.92 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.733 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.86 -57.79 10.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 63.520000000000003 111.106 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 1.001 ' CE2' HD11 ' A' ' 100' ' ' LEU . 71.6 t80 -49.8 -59.26 4.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.939 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.045 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -38.6 -50.52 1.6 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 111.082 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.545 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.13 -28.74 73.91 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.758 -0.734 . . . . 74.319999999999993 112.443 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.641 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.62 -25.54 61.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.818 0.342 . . . . 61.549999999999997 111.173 -179.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.001 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.6 mt -81.34 -37.32 28.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 63.149999999999999 110.92 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.886 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.26 106.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 73.040000000000006 110.813 179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.497 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -87.88 161.14 17.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.955 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.6 ' NE2' ' HB1' ' A' ' 24' ' ' ALA . 44.9 mm-40 -143.31 145.03 32.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 74.150000000000006 110.922 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -173.0 58.93 0.15 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.762 -0.732 . . . . 43.530000000000001 112.48 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.63 -163.31 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 72.219999999999999 112.32 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.0 OUTLIER -125.52 -76.15 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 75.030000000000001 110.9 -179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.559 ' N ' ' CG ' ' A' ' 106' ' ' TYR . 30.0 mmt -112.61 71.82 0.75 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 63.299999999999997 110.796 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -79.17 92.8 5.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 73.420000000000002 111.082 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.569 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.5 p -146.69 -51.37 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 64.129999999999995 111.151 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.569 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.1 OUTLIER -95.51 77.81 3.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 110.934 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.478 ' HA ' HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -136.16 71.63 1.42 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.864 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 113' ' ' ARG . 0.0 OUTLIER -101.17 93.7 5.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 62.43 110.854 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.44 ' C ' ' O ' ' A' ' 112' ' ' LYS . 0.7 OUTLIER 34.84 37.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 65.340000000000003 110.893 179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.443 ' OD1' ' C ' ' A' ' 114' ' ' ASP . 4.2 t0 -113.08 -67.27 1.01 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 64.349999999999994 110.868 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.795 HD23 ' H ' ' A' ' 115' ' ' LEU . 2.7 pt? -102.34 -36.18 8.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.198 -0.456 . . . . 74.25 110.915 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.463 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 50.58 101.88 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.736 -0.745 . . . . 75.299999999999997 112.433 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.463 ' C ' ' O ' ' A' ' 116' ' ' GLY . 6.8 p-10 -33.42 112.43 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 51.229999999999997 110.834 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.73 ' HA ' HG13 ' A' ' 121' ' ' VAL . 8.0 ptt180 -142.97 28.97 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.478 . . . . 72.519999999999996 110.867 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.61 -69.45 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.349999999999994 111.072 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.816 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -87.24 -40.02 13.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 64.439999999999998 111.143 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.816 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -51.0 -35.94 15.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 63.539999999999999 111.114 179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 12.6 t -76.81 -43.3 37.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 111.145 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.536 ' O ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -61.3 -49.19 78.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 65.019999999999996 110.854 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.518 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 1.3 p30 -74.17 -26.96 60.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.222 -0.444 . . . . 75.129999999999995 110.849 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.792 ' O ' HG23 ' A' ' 129' ' ' VAL . 2.1 t -69.5 -50.84 41.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.451 . . . . 62.299999999999997 110.83 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 1.5 t -60.57 -38.21 83.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 74.230000000000004 110.896 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 123' ' ' ARG . 10.7 mp -75.6 -54.53 6.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.902 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.941 HD11 HD12 ' A' ' 100' ' ' LEU . 4.3 tt -58.37 -47.22 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 61.030000000000001 111.168 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 125' ' ' CYS . 21.7 t -70.67 -33.17 51.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 74.030000000000001 111.138 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.487 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.28 -38.57 68.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 110.815 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.699 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 8.4 t80 -74.02 -55.82 5.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.839 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.045 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -58.35 -55.3 36.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 72.219999999999999 110.88 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.568 ' O ' HD12 ' A' ' 136' ' ' LEU . 15.3 t80 -46.24 -54.89 8.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 110.9 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -66.3 -27.94 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 60.009999999999998 110.869 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.479 HD23 ' CD2' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -57.45 -42.15 81.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 64.140000000000001 110.887 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.91 HD11 HG21 ' A' ' 12' ' ' THR . 1.2 pp -98.2 -4.5 35.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 60.420000000000002 110.871 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.58 ' HA ' ' HE2' ' A' ' 137' ' ' MET . 0.0 OUTLIER -97.58 24.14 7.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.099999999999994 110.876 179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -90.48 163.79 30.17 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.641 -0.79 . . . . 71.349999999999994 112.469 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 12.1 mmm-85 -51.6 -53.78 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.764 0.316 . . . . 71.519999999999996 110.808 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.27 -44.21 22.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.279 -0.419 . . . . 64.340000000000003 110.825 -179.878 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.468 ' CE1' ' O ' ' A' ' 80' ' ' SER . 25.5 m-70 -55.74 -61.24 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 70.109999999999999 110.941 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.494 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -61.7 -48.63 79.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 54.340000000000003 110.884 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.492 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -50.19 -43.9 52.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.129999999999995 111.089 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.522 ' NH2' ' HB1' ' A' ' 147' ' ' ALA . 7.5 tpm_? -76.41 -48.62 19.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 54.539999999999999 110.791 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.815 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.93 -45.84 5.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 62.039999999999999 110.909 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.739 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -80.85 -30.87 35.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.148 -0.478 . . . . 52.439999999999998 110.913 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.522 ' HB1' ' NH2' ' A' ' 144' ' ' ARG . . . -60.07 -14.8 18.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 55.009999999999998 111.142 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.721 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.6 OUTLIER -110.32 22.43 15.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.443 . . . . 60.350000000000001 110.89 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.33 -8.84 53.13 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.771 -0.728 . . . . 64.239999999999995 112.483 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 56.28 -176.5 0.92 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.725 -0.75 . . . . 72.340000000000003 112.483 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.52 ' CH2' HD22 ' A' ' 136' ' ' LEU . 71.6 m95 -37.9 -28.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.708 0.289 . . . . 72.340000000000003 110.894 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 150' ' ' GLY . 5.8 m-20 -64.32 -47.04 80.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 72.349999999999994 110.844 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.12 -32.22 83.32 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.682 -0.77 . . . . 73.140000000000001 112.456 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.75 ' CE1' HG11 ' A' ' 91' ' ' VAL . 5.6 t80 -67.13 -57.6 6.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 62.25 110.876 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.493 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.1 p -51.24 -41.77 60.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 55.020000000000003 110.888 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.58 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.46 -27.13 41.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 62.5 110.872 -179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.515 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 1.4 t80 -69.72 -44.33 70.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 53.310000000000002 110.831 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.816 ' CB ' HD11 ' A' ' 41' ' ' LEU . 35.3 m-85 -89.56 -3.38 58.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.133 -0.485 . . . . 72.439999999999998 110.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.478 ' CE ' ' O ' ' A' ' 156' ' ' ARG . 0.3 OUTLIER 47.3 82.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 110.845 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.712 ' HB2' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -50.78 152.85 3.24 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 75.209999999999994 110.842 179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.466 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.4 Cg_endo -69.76 -49.8 0.53 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.605 2.203 . . . . 74.450000000000003 112.401 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.515 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.8 OUTLIER -58.55 160.78 9.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.59 0.71 . . . . 75.200000000000003 110.969 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.5 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.8 Cg_endo -69.7 -90.36 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.646 2.231 . . . . 70.099999999999994 112.331 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.419 ' O ' ' C ' ' A' ' 165' ' ' GLY . 1.7 mp -99.02 177.25 5.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.451 . . . . 65.209999999999994 110.942 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.336 0.528 0 N-CA-C 110.295 -1.122 . . . . 64.019999999999996 110.295 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 110.308 -1.117 . . . . 44.439999999999998 110.308 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' -3' ' ' LEU . 53.6 Cg_endo -69.78 -11.63 31.2 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.738 2.292 . . . . 73.140000000000001 112.296 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.446 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.8 OUTLIER -34.39 102.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 72.129999999999995 110.872 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 174.07 170.93 37.96 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 74.340000000000003 112.467 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.4 p -166.91 133.06 2.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.911 0.386 . . . . 63.100000000000001 110.855 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ptp -89.8 -48.16 7.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 65.129999999999995 110.83 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.61 156.07 20.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 70.129999999999995 111.137 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -111.91 -50.13 2.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 110.883 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.8 t -150.21 78.3 1.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 65.200000000000003 110.891 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.49 ' NE2' ' OD2' ' A' ' 6' ' ' ASP . 3.5 pm0 -105.56 -5.26 20.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 51.020000000000003 110.923 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.496 ' CB ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -112.63 169.63 6.15 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.553 0.692 . . . . 75.010000000000005 110.896 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.496 ' HD2' ' CB ' ' A' ' 6' ' ' ASP . 54.2 Cg_endo -69.78 -166.76 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.709 2.273 . . . . 55.130000000000003 112.3 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.673 ' C ' HD12 ' A' ' 8' ' ' LEU . 2.7 pp -69.85 -16.96 63.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.099999999999994 110.971 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -60.76 -67.29 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 65.230000000000004 110.855 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -55.04 -22.54 16.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.464 . . . . 70.209999999999994 110.948 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 27.7 ttm180 -72.45 -30.43 64.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.818 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.6 m -73.32 -46.29 50.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 111.154 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 12.1 tpp180 -56.8 -50.87 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 73.409999999999997 110.877 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.493 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.32 -39.8 95.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.885 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.859 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -65.56 -41.91 92.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.933 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.846 ' HB3' HG13 ' A' ' 129' ' ' VAL . 4.3 mp -71.46 -48.1 51.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 62.409999999999997 110.922 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.565 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.1 OUTLIER -66.01 -44.83 83.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.229 -0.441 . . . . 65.319999999999993 110.842 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.424 ' CG ' HG21 ' A' ' 35' ' ' THR . 9.0 t0 -55.29 -37.7 67.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.455 . . . . 25.210000000000001 110.825 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.98 -42.73 94.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 70.420000000000002 110.944 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.568 HG21 ' CB ' ' A' ' 125' ' ' CYS . 6.2 mm -51.05 -46.85 31.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.151 -0.477 . . . . 75.219999999999999 111.106 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -60.62 -44.47 96.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 71.409999999999997 110.895 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.638 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.0 -31.05 62.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.46 -13.47 40.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.975 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.59 ' CB ' HG21 ' A' ' 121' ' ' VAL . . . -82.08 17.14 1.68 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 51.119999999999997 111.097 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 7.2 mtp180 -113.35 114.7 27.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 73.150000000000006 110.933 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -33.14 149.31 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.66 0.743 . . . . 63.240000000000002 110.856 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.91 29.85 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.69 2.26 . . . . 72.219999999999999 112.386 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -86.1 5.62 32.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 110.844 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.3 t -139.47 140.54 25.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.653 0.739 . . . . 64.340000000000003 111.104 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 137.17 35.08 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.761 2.307 . . . . 72.329999999999998 112.341 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -80.88 157.22 71.9 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.632 0.73 . . . . 73.420000000000002 110.839 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 169.99 17.7 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.612 2.208 . . . . 63.240000000000002 112.338 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 170.21 17.07 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.677 2.251 . . . . 71.109999999999999 112.351 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 165.38 31.11 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.712 2.275 . . . . 75.310000000000002 112.382 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.474 HG23 ' CB ' ' A' ' 39' ' ' ALA . 0.4 OUTLIER -99.28 -46.43 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 65.349999999999994 111.139 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.611 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -138.28 -176.04 4.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 61.420000000000002 110.854 -179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.566 HG23 ' OXT' ' A' ' 165' ' ' GLY . 1.9 t -58.07 -52.14 62.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.094 -0.503 . . . . 72.310000000000002 111.197 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.673 ' O ' HD22 ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.64 -29.08 69.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 72.109999999999999 110.855 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.611 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.73 -36.16 70.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.171 -0.468 . . . . 62.200000000000003 111.124 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.44 70.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.455 . . . . 53.130000000000003 111.171 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.836 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -57.57 -55.93 28.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 62.219999999999999 110.893 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.82 HD11 HG12 ' A' ' 91' ' ' VAL . 0.5 OUTLIER -53.48 -48.22 69.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 72.349999999999994 110.91 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.408 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.41 -26.73 20.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 65.129999999999995 110.875 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.32 -45.11 8.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.891 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.773 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.4 m -91.2 -54.96 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 72.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.771 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -49.5 -37.18 25.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 75.319999999999993 111.15 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.524 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.43 -33.49 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 43.020000000000003 110.861 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.566 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.68 -31.31 36.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 72.329999999999998 110.899 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.566 HD13 ' HG3' ' A' ' 48' ' ' GLN . 17.2 mm -64.95 -33.42 63.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.120000000000005 111.101 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.703 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.0 mt-30 -81.65 -61.22 1.99 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 73.019999999999996 110.925 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.91 -18.82 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 53.130000000000003 110.974 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.6 pt-20 -96.43 -41.8 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.931 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.622 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 96.8 m-70 -104.24 -44.17 5.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 65.549999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.8 -23.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 110.903 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -46.73 -32.18 3.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 72.5 110.926 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -104.85 -35.79 7.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 73.019999999999996 110.901 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.622 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-30 -53.55 -54.15 41.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 75.450000000000003 110.966 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.0 t -56.16 -38.95 71.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 42.119999999999997 110.893 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 t -54.53 -33.94 60.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.13 -0.486 . . . . 54.240000000000002 110.857 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.963 ' CE1' HD23 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -80.31 -53.02 7.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.499 . . . . 75.109999999999999 110.851 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.73 ' N ' ' CD1' ' A' ' 60' ' ' PHE . 3.3 p -41.09 -46.52 2.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 71.5 110.913 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.517 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.2 mt-10 -89.6 33.74 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.019999999999996 110.923 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 60' ' ' PHE . 22.8 t -118.17 -68.21 0.93 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 70.219999999999999 110.799 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -101.74 -33.68 9.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 73.439999999999998 110.918 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 99.77 7.08 53.89 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 14.539999999999999 112.474 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.69 31.8 0.36 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 72.329999999999998 110.886 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.673 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.61 -34.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 110.886 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.655 ' HB2' HD13 ' A' ' 127' ' ' LEU . 1.4 tp -78.97 -51.82 9.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.913 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 16.1 mm-40 -51.62 -30.77 22.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.931 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.963 HD23 ' CE1' ' A' ' 60' ' ' PHE . 1.3 mm? -80.37 -36.19 34.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 74.310000000000002 110.903 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.701 HG23 ' CD1' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -60.99 -44.52 98.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.219999999999999 111.108 179.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.698 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 5.3 ptpt -72.0 -41.59 67.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 74.239999999999995 110.926 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.36 -49.06 73.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.901 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.681 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.3 mmm -58.95 -55.38 35.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 70.019999999999996 110.904 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -51.78 -21.42 2.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 60.420000000000002 111.075 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.26 -29.99 28.0 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.241 -0.436 . . . . 74.409999999999997 110.891 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.888 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -80.28 -48.37 13.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.46 . . . . 73.219999999999999 110.887 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.942 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.58 -60.07 2.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.298 -0.41 . . . . 63.399999999999999 110.956 179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.49 154.57 21.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 72.209999999999994 110.908 179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.42 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.2 OUTLIER -166.62 -164.71 0.68 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 73.510000000000005 110.887 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' CA ' ' HD3' ' A' ' 140' ' ' ARG . 0.9 OUTLIER -100.92 -60.17 1.57 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.163 -0.472 . . . . 65.420000000000002 110.941 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.532 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -85.6 11.72 10.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 74.340000000000003 110.861 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.601 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -104.19 128.0 51.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 73.319999999999993 110.865 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -65.6 72.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 75.209999999999994 110.901 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.801 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -59.92 115.24 3.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.889 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.39 159.88 19.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.103 -0.499 . . . . 74.319999999999993 110.857 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.704 ' NE1' HD13 ' A' ' 148' ' ' LEU . 6.6 m95 -50.99 -38.81 53.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 73.340000000000003 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -30.6 63.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.32 -0.4 . . . . 72.340000000000003 110.834 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.538 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -74.51 -39.55 62.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 65.25 110.93 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.801 HD21 ' CD2' ' A' ' 85' ' ' PHE . 4.1 mm? -57.55 -55.67 31.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 64.200000000000003 110.898 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.82 HG12 HD11 ' A' ' 42' ' ' LEU . 16.2 m -61.69 -31.4 50.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 71.030000000000001 111.174 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.7 tmm? -63.21 -44.78 94.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.144 -0.48 . . . . 73.019999999999996 110.847 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.666 HD11 HD22 ' A' ' 132' ' ' LEU . 5.8 tp -58.41 -39.44 79.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.284 -0.416 . . . . 74.420000000000002 110.914 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.803 HD12 ' HG ' ' A' ' 42' ' ' LEU . 8.7 mt -66.43 -48.26 70.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 65.319999999999993 110.937 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.771 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -52.2 65.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.472 . . . . 52.130000000000003 111.131 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.828 ' CE2' HD21 ' A' ' 100' ' ' LEU . 65.9 t80 -55.11 -59.32 4.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.195 -0.457 . . . . 71.109999999999999 110.832 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.111 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.32 -60.32 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.105 -0.498 . . . . 54.530000000000001 111.113 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.18 -33.08 44.7 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.762 -0.732 . . . . 75.239999999999995 112.474 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.663 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -68.94 -26.0 64.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.79 0.329 . . . . 74.519999999999996 111.119 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.839 HD12 HD11 ' A' ' 128' ' ' ILE . 3.2 mt -78.06 -34.02 50.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 71.319999999999993 110.97 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 5.4 tpp -33.61 97.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.164 -0.471 . . . . 65.239999999999995 110.886 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -80.4 158.07 26.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.23 -0.441 . . . . 65.310000000000002 110.882 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.528 ' NE2' HD11 ' A' ' 120' ' ' ILE . 13.3 mm-40 -152.56 130.4 11.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 65.219999999999999 110.956 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.539 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -156.38 46.8 0.5 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 73.109999999999999 112.499 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.1 Cg_endo -69.8 -163.69 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.64 2.227 . . . . 63.229999999999997 112.328 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.484 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -124.77 -68.12 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 74.040000000000006 110.901 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.74 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.25 73.62 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.186 -0.461 . . . . 54.340000000000003 110.869 179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.77 76.52 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 42.520000000000003 111.123 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.624 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.3 p -137.25 -50.55 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 44.5 111.095 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.624 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.1 mtmt -97.68 77.07 2.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.916 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -134.4 147.41 50.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 63.25 110.902 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.441 ' HG2' ' CB ' ' A' ' 114' ' ' ASP . 19.8 ttpt -64.29 -6.27 6.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 65.109999999999999 110.914 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.432 ' HD2' ' C ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER 41.59 40.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 73.400000000000006 110.912 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.441 ' CB ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -100.92 -63.82 1.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.891 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -62.72 -8.45 6.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 71.25 110.931 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 137.16 -141.14 12.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.737 -0.744 . . . . 63.340000000000003 112.492 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -103.02 -38.06 7.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.807 0.337 . . . . 71.299999999999997 110.89 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.86 ' O ' HG22 ' A' ' 122' ' ' THR . 18.3 mmm180 -154.61 176.13 12.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 75.400000000000006 110.867 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.571 HG13 ' N ' ' A' ' 120' ' ' ILE . 9.1 p -78.76 -49.33 20.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 61.43 111.154 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.571 ' N ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -62.81 -36.38 75.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 65.010000000000005 111.109 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.668 HG12 ' HB2' ' A' ' 118' ' ' ARG . 6.7 p -68.2 -54.29 23.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 63.240000000000002 111.114 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.86 HG22 ' O ' ' A' ' 118' ' ' ARG . 4.3 t -62.48 -38.62 90.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 72.120000000000005 111.123 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -73.06 -40.33 65.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 74.140000000000001 110.866 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.543 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 26.6 t70 -73.14 -34.56 66.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.25 110.863 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 129' ' ' VAL . 4.2 p -63.8 -38.24 90.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.461 . . . . 61.119999999999997 110.923 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 8.0 t -66.35 -54.38 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 74.0 110.906 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.938 HD12 ' N ' ' A' ' 128' ' ' ILE . 2.8 pp -65.06 -54.26 32.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 61.350000000000001 110.919 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.938 ' N ' HD12 ' A' ' 127' ' ' LEU . 5.1 tt -53.28 -46.96 57.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 111.086 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.846 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.8 t -71.97 -33.08 46.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.103 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.472 ' ND2' ' C ' ' A' ' 130' ' ' ASN . 0.3 OUTLIER -56.64 -35.88 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 72.439999999999998 110.911 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.698 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 7.6 t80 -74.14 -55.23 6.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.822 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.111 HD11 ' HB2' ' A' ' 97' ' ' ALA . 10.4 mt -61.39 -55.29 33.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 72.120000000000005 110.859 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.582 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 21.9 t80 -48.0 -49.57 30.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.246 -0.433 . . . . 75.349999999999994 110.914 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -69.28 -28.42 66.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 65.340000000000003 110.866 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.535 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.19 -44.6 83.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.442 . . . . 75.299999999999997 110.93 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.595 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.1 pp -97.12 -22.71 16.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.009999999999998 110.907 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.595 ' HE2' HD12 ' A' ' 136' ' ' LEU . 17.4 mmt -83.77 24.09 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.845 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -92.5 155.05 22.52 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.794 -0.717 . . . . 61.210000000000001 112.5 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 9.7 mtt85 -50.29 -47.65 55.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.828 0.347 . . . . 74.400000000000006 110.918 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.501 ' HD3' ' CA ' ' A' ' 81' ' ' LYS . 3.5 ttm105 -73.32 -59.5 2.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 71.200000000000003 110.89 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 80' ' ' SER . 48.7 m80 -56.32 -61.47 2.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 70.420000000000002 110.811 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 138' ' ' GLY . 0.0 OUTLIER -43.97 -49.86 8.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 64.439999999999998 110.843 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.48 -41.12 52.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 72.540000000000006 111.089 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -76.5 -50.48 13.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 72.510000000000005 110.822 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.816 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.66 -45.98 7.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.129999999999995 110.851 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.741 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.21 -32.82 33.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.099999999999994 110.852 179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.5 -14.97 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 72.340000000000003 111.034 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.704 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.53 22.86 14.95 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 74.030000000000001 110.971 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.3 -0.25 57.1 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.745 -0.74 . . . . 64.450000000000003 112.406 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 50.62 -176.45 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.75 -0.738 . . . . 72.409999999999997 112.515 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.453 ' HZ2' HD11 ' A' ' 136' ' ' LEU . 76.9 m95 -37.73 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.795 0.331 . . . . 75.239999999999995 110.944 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.9 t70 -64.62 -47.45 78.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 74.530000000000001 110.87 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -66.53 -27.6 73.25 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.711 -0.757 . . . . 63.399999999999999 112.555 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.9 t80 -67.41 -60.88 2.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.853 0.358 . . . . 71.230000000000004 110.922 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 p -50.98 -36.58 39.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.825 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.562 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.63 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.177 -0.465 . . . . 64.409999999999997 110.848 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.588 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -75.42 -41.6 55.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 73.0 110.884 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.836 ' CB ' HD11 ' A' ' 41' ' ' LEU . 31.3 m-85 -91.22 -0.38 57.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 74.409999999999997 110.832 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp 60.55 73.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 53.130000000000003 110.858 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.611 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.1 t30 -53.48 139.88 47.51 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.631 0.729 . . . . 65.030000000000001 110.888 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.82 -46.4 1.21 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.727 2.285 . . . . 64.319999999999993 112.324 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.421 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 1.2 mm? -88.25 136.81 31.4 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.57 0.7 . . . . 73.219999999999999 110.89 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.81 -51.28 0.39 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.642 2.228 . . . . 63.149999999999999 112.343 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -85.06 -168.36 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.251 -0.431 . . . . 72.129999999999995 110.946 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.566 ' OXT' HG23 ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 75.219999999999999 110.27 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.289 -1.124 . . . . 12.130000000000001 110.289 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.48 ' O ' ' C ' ' A' ' -3' ' ' LEU . 54.5 Cg_endo -69.8 -52.02 0.35 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.669 2.246 . . . . 74.439999999999998 112.343 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.48 ' C ' ' O ' ' A' ' -4' ' ' PRO . 5.3 tp 31.63 53.36 0.23 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.449 . . . . 63.130000000000003 110.914 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 167.2 159.79 13.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 52.219999999999999 112.448 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.5 m -171.94 121.79 0.48 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.816 0.341 . . . . 70.140000000000001 110.836 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.433 ' HG2' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER -89.64 -39.97 12.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 75.030000000000001 110.91 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.433 ' N ' ' HG2' ' A' ' 1' ' ' MET . . . -123.97 164.65 18.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 71.430000000000007 111.067 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -126.38 -65.76 0.96 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 71.140000000000001 110.9 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 t -137.77 94.77 2.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.230000000000004 110.871 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -64.67 -43.82 92.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 71.310000000000002 110.914 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -86.82 156.39 55.5 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.6 0.714 . . . . 71.5 110.859 179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -38.28 8.05 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.725 2.283 . . . . 74.129999999999995 112.368 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.798 HD23 ' C ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -104.7 6.85 34.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 75.349999999999994 110.97 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.649 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 4.8 t60 -54.61 -72.76 0.06 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.135 -0.484 . . . . 74.019999999999996 110.87 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.649 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 81.5 tt0 -59.74 -14.91 16.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 71.420000000000002 110.861 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -74.62 -39.36 62.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 75.310000000000002 110.884 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 1.039 HG21 HD21 ' A' ' 136' ' ' LEU . 80.9 m -73.45 -36.68 65.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 72.040000000000006 111.146 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -63.93 -51.97 61.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 73.219999999999999 110.87 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.07 -43.61 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.139 -0.482 . . . . 70.109999999999999 110.845 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.739 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.06 -46.63 88.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.208 -0.451 . . . . 53.539999999999999 110.886 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.7 mp -67.38 -48.92 65.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 44.210000000000001 110.948 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.458 ' HA ' HG21 ' A' ' 129' ' ' VAL . 6.9 m -62.69 -40.27 96.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 64.230000000000004 110.868 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -45.34 78.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 73.450000000000003 110.845 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.645 ' CE1' HG21 ' A' ' 46' ' ' THR . 74.8 t80 -58.72 -41.68 86.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 64.25 110.915 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.525 HG13 ' CG2' ' A' ' 129' ' ' VAL . 5.7 mm -52.87 -44.55 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 62.240000000000002 111.127 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.45 -47.71 72.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.5 . . . . 75.510000000000005 110.873 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.437 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -55.74 -28.76 57.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.124 -0.489 . . . . 73.120000000000005 110.859 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.34 -13.59 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.176 -0.465 . . . . 72.0 110.857 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.559 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -82.86 17.08 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 53.409999999999997 111.121 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.489 ' NE ' ' HD3' ' A' ' 32' ' ' PRO . 40.8 mtt85 -113.59 112.69 23.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 63.229999999999997 110.808 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 25' ' ' ARG . 9.1 mt-10 -37.9 153.76 0.13 Allowed Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.639 0.733 . . . . 70.439999999999998 110.862 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 -9.66 26.67 Favored 'Trans proline' 0 C--O 1.231 0.126 0 C-N-CA 122.709 2.272 . . . . 72.409999999999997 112.335 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -89.74 5.51 45.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 74.209999999999994 110.907 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 t -139.02 139.16 22.55 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.554 0.692 . . . . 72.409999999999997 111.141 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 136.18 32.35 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.73 2.287 . . . . 73.549999999999997 112.326 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 0.7 OUTLIER -83.38 156.32 65.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.674 0.749 . . . . 65.209999999999994 110.885 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.489 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.5 Cg_endo -69.74 167.61 23.91 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 75.219999999999999 112.283 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 170.1 17.37 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.763 2.309 . . . . 71.510000000000005 112.352 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 178.89 4.06 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.711 2.274 . . . . 74.219999999999999 112.361 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.84 -43.01 2.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 62.009999999999998 111.132 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.506 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 93.3 p -136.44 -174.94 3.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 65.310000000000002 110.917 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.435 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -62.71 -47.2 94.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 64.219999999999999 111.122 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.736 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.8 pt-20 -63.62 -30.88 71.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.139 -0.482 . . . . 75.420000000000002 110.907 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.506 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -74.0 -34.9 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 72.129999999999995 111.073 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -53.5 40.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 51.219999999999999 111.08 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.88 HD13 ' CE1' ' A' ' 154' ' ' PHE . 0.0 OUTLIER -62.74 -50.89 69.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 75.5 110.94 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.938 HD13 HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -50.1 -46.27 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 72.219999999999999 110.899 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.513 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -63.68 -25.91 68.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.897 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.11 -39.06 18.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.32 110.9 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.673 HG23 ' N ' ' A' ' 46' ' ' THR . 35.4 m -90.29 -55.89 5.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.153 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.872 ' HB ' HD12 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -50.77 -36.93 39.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 73.439999999999998 111.105 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.513 ' CG ' ' O ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -58.97 -32.37 69.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.268 -0.424 . . . . 73.019999999999996 110.855 -179.946 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.552 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.44 -31.32 37.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 74.450000000000003 110.95 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.552 HD13 ' HG3' ' A' ' 48' ' ' GLN . 15.1 mm -63.66 -31.85 54.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 74.329999999999998 111.067 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.16 -60.87 2.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 62.520000000000003 110.906 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.34 -20.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 72.299999999999997 110.943 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.528 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 9.7 pt-20 -96.76 -41.44 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 62.539999999999999 110.892 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.3 m-70 -103.51 -44.62 5.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 71.409999999999997 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.71 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.903 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.0 mt-10 -47.64 -32.69 5.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 64.329999999999998 110.877 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 60' ' ' PHE . 10.8 m-85 -102.94 -39.39 6.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 71.409999999999997 110.932 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.4 m-85 -53.03 -55.4 23.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.914 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -49.7 -44.74 48.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.838 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t -51.98 -37.93 54.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.239999999999995 110.798 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 56' ' ' PHE . 92.8 m-85 -79.22 -40.82 29.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.109999999999999 110.861 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 29.4 m -49.13 -38.65 25.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.128 -0.487 . . . . 54.439999999999998 110.878 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -105.74 28.21 7.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.256 -0.429 . . . . 73.420000000000002 110.863 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.2 t -118.57 -68.55 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.853 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.514 ' CB ' ' OD1' ' A' ' 66' ' ' ASN . 0.9 OUTLIER -86.95 -22.09 25.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 63.140000000000001 110.866 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.24 -4.94 57.15 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.725 -0.75 . . . . 72.030000000000001 112.469 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.845 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -83.08 33.49 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 73.209999999999994 110.842 -179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.74 ' O ' HD13 ' A' ' 100' ' ' LEU . 9.3 mtt-85 -32.0 -34.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 110.866 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.552 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.7 tp -75.64 -51.51 12.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.943 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.502 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 2.6 mp0 -48.47 -36.08 14.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.887 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.845 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -75.48 -35.92 60.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.105 -0.498 . . . . 54.439999999999998 110.965 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.983 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.69 -46.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.176 -0.465 . . . . 71.319999999999993 111.147 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 1.3 ptpt -73.0 -44.52 60.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.430000000000007 110.873 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.4 -50.75 68.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 60.5 110.86 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.709 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.6 mmm -58.36 -55.6 32.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 62.210000000000001 110.888 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.909 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.1 -21.69 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 53.119999999999997 111.028 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -82.23 -32.07 29.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.256 -0.429 . . . . 65.230000000000004 110.804 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.858 ' HG2' HD23 ' A' ' 78' ' ' LEU . 10.0 ptpt -77.08 -48.14 18.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.446 . . . . 52.439999999999998 110.928 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.913 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.78 -56.49 3.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 71.530000000000001 110.886 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.913 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.35 154.27 18.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 70.510000000000005 110.927 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.438 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -162.42 -178.21 6.14 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.768 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.54 -33.66 10.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.04 -0.527 . . . . 71.340000000000003 110.894 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.431 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.2 OUTLIER -102.86 -10.64 18.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 53.240000000000002 110.83 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.599 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -90.75 127.59 36.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.912 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.57 74.47 0.06 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 60.450000000000003 110.889 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.456 ' C ' ' CD1' ' A' ' 85' ' ' PHE . 0.0 OUTLIER -51.62 172.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 71.150000000000006 110.899 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -137.72 174.85 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 60.439999999999998 110.83 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.899 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 6.0 m95 -66.43 -38.45 87.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.142 -0.481 . . . . 73.120000000000005 110.917 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.6 t -59.64 -33.94 72.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 73.209999999999994 110.827 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -74.5 -36.36 63.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 54.210000000000001 110.883 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.899 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.0 OUTLIER -56.52 -57.02 14.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 71.340000000000003 110.891 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.548 HG11 ' CE1' ' A' ' 154' ' ' PHE . 7.7 m -63.36 -31.76 54.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.236 -0.438 . . . . 64.540000000000006 111.114 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.433 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.5 tmm? -63.41 -42.37 98.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 75.120000000000005 110.885 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -63.09 -35.72 81.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.864 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.938 HD12 HD13 ' A' ' 42' ' ' LEU . 8.7 mt -68.9 -46.91 67.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 72.129999999999995 110.951 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.762 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.73 -58.1 9.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.165 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.984 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.3 t80 -50.11 -59.87 3.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.819 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.814 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.26 -49.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.420000000000002 111.074 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.514 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.06 -27.64 73.52 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.798 -0.715 . . . . 71.530000000000001 112.532 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.657 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.38 -25.37 59.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.803 0.335 . . . . 73.409999999999997 111.11 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.984 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -83.09 -30.1 28.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.293 -0.412 . . . . 54.200000000000003 110.956 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.526 ' C ' ' O ' ' A' ' 100' ' ' LEU . 2.5 tpp -27.1 99.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.148 -0.478 . . . . 74.040000000000006 110.905 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -70.07 145.75 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 74.439999999999998 110.948 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.559 ' NE2' ' HB1' ' A' ' 24' ' ' ALA . 38.0 mm-40 -138.53 111.55 7.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 74.319999999999993 110.884 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -173.72 54.01 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 75.099999999999994 112.506 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HB3' HG23 ' A' ' 120' ' ' ILE . 53.7 Cg_endo -69.83 -163.04 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.679 2.253 . . . . 74.349999999999994 112.329 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.2 OUTLIER -124.55 -77.09 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.225 -0.443 . . . . 54.119999999999997 110.989 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.538 ' SD ' ' C ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -162.28 158.5 24.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 74.349999999999994 110.917 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.478 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -124.47 -174.25 2.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 111.069 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.598 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.7 p -155.6 -52.93 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 53.420000000000002 111.091 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.598 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.1 OUTLIER -92.73 78.99 4.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 73.310000000000002 110.833 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.416 ' OE1' ' CA ' ' A' ' 116' ' ' GLY . 24.6 mm-40 -141.77 155.2 45.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 55.329999999999998 110.867 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.535 ' HB3' HD11 ' A' ' 115' ' ' LEU . 47.4 tttm -65.6 -69.39 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 72.5 110.846 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -134.03 -89.05 0.38 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.263 -0.426 . . . . 63.32 110.862 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -119.22 -14.47 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 60.109999999999999 110.791 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -58.13 -11.78 2.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 72.0 110.907 -179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.416 ' CA ' ' OE1' ' A' ' 111' ' ' GLN . . . -78.19 64.45 3.45 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.769 -0.729 . . . . 74.420000000000002 112.457 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.526 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.1 t30 -130.68 4.2 4.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.815 0.341 . . . . 74.319999999999993 110.9 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.776 ' HA ' HG13 ' A' ' 121' ' ' VAL . 4.5 ppt_? -76.67 34.64 0.14 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 64.200000000000003 110.85 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.552 HG11 ' CE1' ' A' ' 106' ' ' TYR . 96.6 t -79.51 -69.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.1 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.943 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -87.22 -33.11 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 73.219999999999999 111.155 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.943 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -62.55 -41.55 92.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 71.230000000000004 111.121 179.836 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.593 HG23 ' N ' ' A' ' 123' ' ' ARG . 6.4 t -62.05 -50.53 71.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 64.120000000000005 111.113 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.593 ' N ' HG23 ' A' ' 122' ' ' THR . 12.3 ptm180 -57.48 -40.44 78.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 71.310000000000002 110.864 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.48 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 56.5 t0 -74.7 -36.32 62.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 71.400000000000006 110.878 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.671 ' O ' HG23 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -62.05 -43.03 99.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 73.439999999999998 110.84 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.46 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.6 t -62.01 -54.16 45.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 71.219999999999999 110.902 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.88 -54.48 30.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 73.0 110.912 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.983 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.6 tt -54.99 -46.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.140000000000001 111.113 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.4 t -73.02 -32.83 41.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 70.239999999999995 111.155 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -60.06 -43.01 95.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 72.400000000000006 110.942 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 12.4 t80 -65.44 -54.25 31.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 71.519999999999996 110.798 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.814 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.7 OUTLIER -64.99 -56.07 15.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.174 -0.466 . . . . 44.450000000000003 110.922 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.77 ' O ' HD23 ' A' ' 136' ' ' LEU . 23.5 t80 -44.18 -57.11 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 73.319999999999993 110.925 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -60.14 -28.68 68.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 64.239999999999995 110.918 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.909 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.0 tp -63.23 -53.15 57.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 75.329999999999998 110.996 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 12' ' ' THR . 0.5 OUTLIER -87.3 -7.71 57.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 75.319999999999993 110.956 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.558 ' N ' HD23 ' A' ' 136' ' ' LEU . 13.6 tpp -103.33 24.62 10.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.905 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.46 170.44 42.53 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.778 -0.725 . . . . 71.319999999999993 112.47 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -53.95 50.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.84 0.353 . . . . 71.450000000000003 110.845 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.51 -44.3 24.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 75.299999999999997 110.826 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.551 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 49.9 m80 -56.65 -60.99 2.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.25 -0.432 . . . . 61.25 110.875 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.493 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -54.79 -46.04 74.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 74.209999999999994 110.899 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.47 -41.51 63.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 111.094 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.2 tpp85 -76.23 -49.13 17.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 72.340000000000003 110.868 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.841 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.83 -46.32 7.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 73.530000000000001 110.895 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.841 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.76 -37.99 26.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.267 -0.424 . . . . 71.420000000000002 110.887 179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -52.62 -16.43 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 111.149 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.14 26.63 10.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.5 110.881 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 101.1 -16.96 56.73 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.812 -0.709 . . . . 75.439999999999998 112.514 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.491 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 64.62 -172.3 19.22 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 45.5 112.467 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.543 ' CG ' ' OE1' ' A' ' 38' ' ' GLU . 41.0 m95 -37.67 -38.26 0.26 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.73 0.3 . . . . 70.200000000000003 110.872 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.523 ' O ' ' CD ' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -54.52 -49.91 69.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.273 -0.421 . . . . 75.239999999999995 110.881 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 157' ' ' PHE . . . -61.61 -29.94 73.29 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.72 -0.752 . . . . 54.509999999999998 112.494 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.88 ' CE1' HD13 ' A' ' 41' ' ' LEU . 1.0 OUTLIER -64.68 -33.38 75.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.861 0.362 . . . . 64.209999999999994 110.841 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.796 ' HA ' HD12 ' A' ' 41' ' ' LEU . 1.8 m -69.64 -47.34 63.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 62.299999999999997 110.893 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.523 ' CD ' ' O ' ' A' ' 152' ' ' ASP . 0.4 OUTLIER -78.69 -26.82 45.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 64.450000000000003 110.944 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.5 t80 -62.95 -41.09 99.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 75.409999999999997 110.886 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.78 ' HB2' HD11 ' A' ' 41' ' ' LEU . 32.4 m-85 -103.98 -6.73 20.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 74.219999999999999 110.899 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.02 84.38 0.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.48 . . . . 63.420000000000002 110.902 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.5 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.3 OUTLIER -49.04 147.22 5.01 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.61 0.719 . . . . 72.340000000000003 110.9 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.443 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.83 -37.63 8.74 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.677 2.251 . . . . 71.010000000000005 112.349 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.5 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 2.6 mt -64.09 154.11 83.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.656 0.741 . . . . 73.099999999999994 110.891 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.79 -34.18 14.99 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.678 2.252 . . . . 72.129999999999995 112.357 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.6 mp -63.89 167.61 5.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.212 -0.449 . . . . 62.009999999999998 110.887 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.582 0 N-CA-C 110.287 -1.125 . . . . 73.540000000000006 110.287 179.926 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 139' ' ' ARG . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.233 -1.147 . . . . 43.210000000000001 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' -2' ' ' GLY . 54.0 Cg_endo -69.77 -48.57 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.688 2.258 . . . . 70.030000000000001 112.358 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' -3' ' ' LEU . 4.1 mm? -37.84 93.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 74.329999999999998 110.93 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 61.55 75.91 0.27 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.834 -0.698 . . . . 50.240000000000002 112.474 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.8 m -48.31 175.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 70.329999999999998 110.883 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -15.81 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 61.299999999999997 110.844 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.71 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -176.83 177.45 1.33 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.425 . . . . 70.239999999999995 111.089 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -116.53 -10.41 11.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 61.140000000000001 110.885 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.5 p -122.8 -19.83 6.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.471 . . . . 73.519999999999996 110.893 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.71 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 29.1 mt-30 -80.34 4.32 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.073 -0.512 . . . . 72.420000000000002 110.894 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -106.62 86.84 2.41 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.622 0.725 . . . . 74.099999999999994 110.839 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 5' ' ' GLN . 54.3 Cg_endo -69.73 -16.08 37.5 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.7 2.267 . . . . 73.519999999999996 112.318 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.46 HD22 ' HD1' ' A' ' 151' ' ' TRP . 0.2 OUTLIER -112.55 21.97 15.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.271 -0.422 . . . . 51.439999999999998 110.93 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -69.54 -71.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 71.439999999999998 110.9 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.48 -23.1 66.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.189 -0.459 . . . . 71.209999999999994 110.844 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.88 -30.93 65.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 110.817 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.547 ' CG2' HD11 ' A' ' 136' ' ' LEU . 39.5 m -75.06 -54.06 7.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.426 . . . . 71.430000000000007 111.163 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.1 tpt180 -50.46 -52.2 40.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 74.510000000000005 110.806 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -60.5 -44.94 95.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 64.329999999999998 110.876 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.888 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -58.85 -46.03 88.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.926 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.655 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.1 mp -68.03 -48.27 66.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 110.93 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.48 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.4 OUTLIER -60.84 -39.31 88.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 72.120000000000005 110.815 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -43.08 86.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.466 . . . . 72.439999999999998 110.898 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.643 ' CE1' HG21 ' A' ' 46' ' ' THR . 76.0 t80 -60.94 -37.36 82.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 75.510000000000005 110.937 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.782 HG21 ' CB ' ' A' ' 125' ' ' CYS . 5.3 mm -57.74 -44.78 86.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.058 -0.519 . . . . 72.409999999999997 111.11 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.2 -51.8 49.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 75.25 110.87 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.595 ' CD2' ' HG2' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -56.81 -32.25 65.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.88 -179.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -74.02 -31.25 62.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 72.349999999999994 110.882 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 25' ' ' ARG . . . -70.9 -13.28 61.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.135 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' CB ' ' HB3' ' A' ' 31' ' ' GLU . 0.3 OUTLIER -33.39 111.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 73.349999999999994 110.908 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.61 ' HB2' HG22 ' A' ' 29' ' ' THR . 9.5 mt-10 -54.39 151.21 14.36 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 121.642 0.734 . . . . 72.409999999999997 110.902 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 -10.06 27.6 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.647 2.231 . . . . 63.409999999999997 112.308 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -109.34 5.71 23.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 51.439999999999998 110.773 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.61 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.3 t -145.7 141.32 16.68 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.596 0.712 . . . . 75.340000000000003 111.087 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 137.38 35.19 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.68 2.253 . . . . 75.209999999999994 112.38 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.595 ' HG2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.4 152.81 95.82 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.619 0.724 . . . . 72.530000000000001 110.93 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.86 170.17 17.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.587 2.192 . . . . 63.299999999999997 112.356 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 170.61 16.1 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.711 2.274 . . . . 63.119999999999997 112.308 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -179.44 2.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.635 2.223 . . . . 73.230000000000004 112.368 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.471 HG21 ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -108.53 -51.19 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 73.200000000000003 111.196 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.733 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 58.2 m -151.63 -172.85 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 73.209999999999994 110.873 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.467 ' N ' ' HA3' ' A' ' 165' ' ' GLY . 2.2 t -53.24 -55.02 14.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.161 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -58.34 -31.49 67.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 61.119999999999997 110.914 179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.733 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.47 -35.77 70.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 65.140000000000001 111.048 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.76 76.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 111.055 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.3 OUTLIER -55.36 -55.65 29.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.272 -0.422 . . . . 73.140000000000001 110.915 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -52.07 -47.18 65.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.206 -0.452 . . . . 71.450000000000003 110.874 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -53.61 -27.13 25.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 64.340000000000003 110.842 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 3.5 m -91.49 -44.49 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.241 -0.436 . . . . 73.519999999999996 110.85 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.841 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.33 -55.11 6.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 64.549999999999997 111.19 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.784 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.58 -35.84 31.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.167 -0.47 . . . . 72.049999999999997 111.127 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.514 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -60.92 -32.76 72.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.258 -0.428 . . . . 51.509999999999998 110.83 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.85 -31.41 40.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 63.039999999999999 110.865 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.579 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.3 mm -63.81 -33.49 62.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 71.099999999999994 111.166 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.2 mt-30 -81.65 -61.89 1.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.450000000000003 110.888 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -47.79 -19.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 62.329999999999998 110.907 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.549 ' HG3' ' CG ' ' A' ' 53' ' ' HIS . 7.4 pt-20 -97.09 -41.74 8.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 75.439999999999998 110.897 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.632 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 64.2 m-70 -104.0 -43.99 5.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 71.420000000000002 110.79 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.35 -24.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.884 -179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.0 mt-10 -46.19 -32.05 2.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 75.109999999999999 110.872 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -104.56 -36.33 7.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 73.030000000000001 110.886 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 8.2 m-30 -52.97 -57.12 11.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 74.409999999999997 110.905 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -49.7 -45.03 48.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 75.340000000000003 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -51.89 -34.63 42.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 75.340000000000003 110.831 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -78.36 -42.52 30.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 75.400000000000006 110.813 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.437 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -50.01 -22.49 1.61 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 55.310000000000002 110.892 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.437 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 6.3 mt-10 -122.26 32.94 5.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 61.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.4 m -118.47 -68.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 72.510000000000005 110.891 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.497 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 1.5 mmp_? -100.82 -14.97 17.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 74.310000000000002 110.887 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.493 ' O ' ' NE ' ' A' ' 67' ' ' ARG . . . 75.38 8.79 84.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.776 -0.726 . . . . 53.130000000000003 112.501 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -86.95 31.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 74.310000000000002 110.824 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.662 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.6 -34.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.109999999999999 110.905 179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.716 ' HB2' HD13 ' A' ' 127' ' ' LEU . 2.3 tp -78.02 -51.34 10.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 73.140000000000001 110.957 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.513 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 41.3 mt-10 -51.55 -31.64 25.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 74.400000000000006 110.867 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.595 ' CD1' ' N ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -78.21 -38.39 43.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 65.540000000000006 110.892 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.865 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.12 -46.44 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 74.439999999999998 111.139 179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.689 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.7 -43.01 63.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 73.540000000000006 110.818 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.513 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -54.8 -47.88 73.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 51.229999999999997 110.91 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.628 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 19.2 mmm -57.17 -56.48 21.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.873 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.5 ' CB ' HD11 ' A' ' 93' ' ' LEU . . . -52.45 -19.48 2.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 50.240000000000002 111.054 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.26 -35.86 40.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 70.140000000000001 110.874 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HG3' HD23 ' A' ' 78' ' ' LEU . 7.9 ptpt -78.5 -48.77 14.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.956 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.937 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.57 1.38 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 74.140000000000001 110.999 179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.937 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -83.41 160.43 21.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.933 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.95 -173.87 3.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 73.430000000000007 110.86 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 140' ' ' ARG . 4.0 ptpt -101.22 -44.08 5.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.219999999999999 110.911 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.88 26.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 74.530000000000001 110.858 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.623 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -84.82 127.51 34.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 72.239999999999995 110.943 -179.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.421 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 9.1 p-10 -67.88 70.98 0.15 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.424 . . . . 75.120000000000005 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.965 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.74 170.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 53.030000000000001 110.889 -179.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -136.17 156.16 49.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 62.43 110.876 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.685 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 2.7 m95 -48.58 -43.61 36.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.21 -0.45 . . . . 73.010000000000005 110.928 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 92' ' ' MET . 2.1 t -53.79 -32.8 53.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 65.540000000000006 110.849 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.2 mm100 -75.44 -42.67 52.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 63.409999999999997 110.91 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.965 HD21 ' CE2' ' A' ' 85' ' ' PHE . 3.2 mm? -51.6 -56.19 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 65.310000000000002 110.936 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.691 HG11 ' CE1' ' A' ' 154' ' ' PHE . 28.1 m -65.05 -31.27 53.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 74.310000000000002 111.131 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.426 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.1 tmm? -58.58 -45.83 88.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 74.140000000000001 110.867 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.67 ' CD2' HD11 ' A' ' 78' ' ' LEU . 7.2 mt -62.68 -44.49 96.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 65.420000000000002 110.87 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 2.9 mp -55.54 -46.36 77.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.89 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.784 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.43 -57.65 10.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 62.310000000000002 111.097 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.938 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.1 t80 -48.75 -59.56 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.428 . . . . 72.519999999999996 110.797 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.114 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -39.81 -49.53 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 111.056 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.528 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -66.75 -27.52 73.32 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.663 -0.78 . . . . 72.450000000000003 112.483 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -71.93 -26.18 62.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 71.010000000000005 111.205 -179.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.938 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.2 mt -82.68 -30.57 29.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 75.120000000000005 110.9 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.458 ' HE1' ' HB2' ' A' ' 124' ' ' ASP . 7.3 tpp -35.52 103.02 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.853 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -81.7 157.08 24.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 60.439999999999998 110.859 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.46 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 0.8 OUTLIER -124.28 150.11 45.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 71.040000000000006 110.931 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.514 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -164.67 48.18 0.29 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.771 -0.728 . . . . 43.109999999999999 112.503 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.3 Cg_endo -69.87 -163.22 0.1 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.716 2.277 . . . . 75.219999999999999 112.335 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.476 ' O ' ' N ' ' A' ' 108' ' ' ALA . 8.4 t80 -124.37 -17.69 6.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.249 -0.432 . . . . 75.019999999999996 110.93 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.508 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 15.4 mmt -37.12 93.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 70.030000000000001 110.884 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.531 ' HB3' ' NE2' ' A' ' 111' ' ' GLN . . . -96.72 -150.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 71.349999999999994 111.18 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.835 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.73 -84.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.311 -0.404 . . . . 74.319999999999993 111.081 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.835 ' N ' HG22 ' A' ' 109' ' ' VAL . 5.1 mtmt -75.91 96.17 3.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 73.140000000000001 110.895 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.531 ' NE2' ' HB3' ' A' ' 108' ' ' ALA . 18.3 mm-40 -141.83 -168.9 2.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 72.120000000000005 110.875 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.428 ' CG ' ' O ' ' A' ' 112' ' ' LYS . 3.5 ptpp? -150.31 117.06 5.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.878 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.37 99.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 74.109999999999999 110.864 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -134.97 -67.02 0.56 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.868 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.818 ' N ' HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.5 -67.19 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.264 -0.426 . . . . 70.310000000000002 110.951 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 127.86 -40.66 1.7 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.737 -0.744 . . . . 74.319999999999993 112.5 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.678 ' ND2' HG11 ' A' ' 121' ' ' VAL . 0.6 OUTLIER -177.94 -170.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.355 . . . . 73.329999999999998 110.868 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.649 ' O ' HG12 ' A' ' 121' ' ' VAL . 7.4 mmt180 -94.88 173.36 7.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 65.430000000000007 110.895 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.722 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.23 -12.66 14.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.450000000000003 111.111 -179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.877 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -53.89 -32.03 21.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.161 -0.472 . . . . 41.340000000000003 111.105 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.877 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -68.25 -49.27 68.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 74.329999999999998 111.176 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.722 ' CG2' HG12 ' A' ' 119' ' ' VAL . 2.5 t -65.76 -42.32 91.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 111.144 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.404 ' CG ' ' N ' ' A' ' 124' ' ' ASP . 5.1 ptm180 -66.67 -42.18 87.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 74.310000000000002 110.9 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 127' ' ' LEU . 17.3 m-20 -70.47 -32.09 69.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.439999999999998 110.84 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.782 ' CB ' HG21 ' A' ' 20' ' ' ILE . 1.4 p -71.19 -35.17 71.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.253 -0.43 . . . . 73.0 110.898 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 49.7 t -63.65 -50.53 68.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.964 HD12 ' N ' ' A' ' 128' ' ' ILE . 3.5 pp -65.45 -54.26 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 110.902 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.964 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.1 tt -54.8 -47.74 74.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.452 . . . . 64.409999999999997 111.064 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.729 HG23 ' O ' ' A' ' 125' ' ' CYS . 73.7 t -70.04 -32.14 50.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 111.124 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -55.94 -40.14 72.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 75.150000000000006 110.893 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.689 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.2 t80 -71.43 -55.5 7.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 64.319999999999993 110.836 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.114 HD11 ' HB2' ' A' ' 97' ' ' ALA . 11.7 mt -59.43 -55.52 33.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.19 -0.459 . . . . 61.549999999999997 110.886 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 13.4 t80 -42.99 -55.53 3.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.244 -0.435 . . . . 74.239999999999995 110.919 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -66.67 -27.12 67.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.058 -0.519 . . . . 65.409999999999997 110.931 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.41 -53.12 61.7 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 74.450000000000003 110.891 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.793 HD23 ' O ' ' A' ' 132' ' ' LEU . 1.6 pt? -86.03 -26.47 25.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.878 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.588 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 25.7 mmt -80.97 26.36 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.129999999999995 110.894 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -91.86 141.98 15.86 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.772 -0.728 . . . . 75.049999999999997 112.448 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.436 ' CZ ' ' HA3' ' A' ' -5' ' ' GLY . 0.0 OUTLIER -44.11 -45.18 8.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.805 0.336 . . . . 64.049999999999997 110.922 -179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.502 ' CD ' ' HB3' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -72.48 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 71.340000000000003 110.827 -179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.66 ' NE2' HD11 ' A' ' 90' ' ' LEU . 8.0 t-80 -58.87 -61.55 2.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.452 . . . . 74.219999999999999 110.924 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.588 ' NH1' ' CE ' ' A' ' 137' ' ' MET . 0.2 OUTLIER -41.14 -54.15 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.833 -179.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -48.03 -40.39 22.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 61.310000000000002 111.067 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 45.6 mtp85 -76.51 -48.15 20.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.509999999999998 110.85 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.838 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.1 OUTLIER -44.03 -44.88 7.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 73.510000000000005 110.948 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.756 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.22 -37.05 29.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 74.239999999999995 110.911 179.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.52 -15.13 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.530000000000001 111.071 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.685 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.55 25.08 12.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 70.340000000000003 110.882 -179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.05 -5.27 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.74 -0.743 . . . . 71.439999999999998 112.462 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.481 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 54.93 -172.45 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.745 -0.741 . . . . 45.009999999999998 112.493 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.46 ' HD1' HD22 ' A' ' 8' ' ' LEU . 62.9 m95 -37.84 -34.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.846 0.355 . . . . 74.319999999999993 110.971 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -60.12 -47.76 84.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 65.430000000000007 110.835 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -28.4 73.54 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.684 -0.77 . . . . 74.540000000000006 112.577 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.694 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 1.6 t80 -60.05 -61.7 2.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 72.209999999999994 110.897 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.415 ' O ' ' N ' ' A' ' 159' ' ' LYS . 1.4 p -53.48 -39.86 64.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 61.439999999999998 110.862 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.495 ' N ' ' HD3' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -69.15 -26.61 64.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 65.099999999999994 110.84 -179.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 2.1 t80 -77.59 -33.34 53.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 70.450000000000003 110.906 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.841 ' CD2' HG11 ' A' ' 45' ' ' VAL . 76.9 m-85 -99.17 -13.77 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 53.0 110.804 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 155' ' ' CYS . 0.5 OUTLIER 65.2 76.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.904 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.499 ' OD1' ' CA ' ' A' ' 41' ' ' LEU . 2.2 t30 -54.91 142.15 56.36 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.677 0.751 . . . . 72.129999999999995 110.899 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.466 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.3 Cg_endo -69.79 -43.85 2.39 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 73.329999999999998 112.331 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 162' ' ' LEU . 4.0 mm? -94.39 144.02 27.29 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.564 0.697 . . . . 74.219999999999999 110.899 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -50.26 0.48 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.697 2.265 . . . . 62.450000000000003 112.335 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.51 HD23 ' C ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -83.43 -172.58 4.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.213 -0.449 . . . . 61.520000000000003 110.953 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.467 ' HA3' ' N ' ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.239 -1.144 . . . . 65.329999999999998 110.239 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.266 -1.134 . . . . 71.409999999999997 110.266 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.73 -17.53 37.65 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.643 2.229 . . . . 75.299999999999997 112.404 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.533 ' CD2' ' N ' ' A' ' -3' ' ' LEU . 0.0 OUTLIER -58.36 78.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 70.140000000000001 110.908 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . -114.11 -1.2 23.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.764 -0.731 . . . . 71.010000000000005 112.493 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.74 77.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.879 0.371 . . . . 64.0 110.851 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.472 ' N ' ' O ' ' A' ' -2' ' ' GLY . 19.9 ptp -91.06 -54.01 4.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.08 -0.509 . . . . 35.229999999999997 110.915 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 5' ' ' GLN . . . -68.27 176.7 2.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 71.439999999999998 111.046 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -100.81 -77.87 0.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 72.299999999999997 110.871 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -61.31 -21.77 64.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.123 -0.489 . . . . 72.340000000000003 110.897 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.451 ' HB2' ' CB ' ' A' ' 2' ' ' ALA . 10.1 mm-40 -88.11 60.18 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 71.310000000000002 110.919 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -53.03 144.3 28.17 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.656 0.741 . . . . 61.340000000000003 110.876 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 2.82 3.22 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.717 2.278 . . . . 51.530000000000001 112.296 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.657 HD13 HH21 ' A' ' 142' ' ' ARG . 0.4 OUTLIER -65.03 -25.82 68.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 61.399999999999999 110.921 179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 2.2 p-80 -71.31 -47.48 56.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.209999999999994 110.846 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -75.66 -21.82 57.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 72.109999999999999 110.888 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.405 HH21 ' CZ ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -75.14 -31.03 60.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 72.319999999999993 110.928 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.473 HG22 ' HD2' ' A' ' 133' ' ' TYR . 24.4 m -78.28 -48.67 15.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.165 -0.47 . . . . 74.519999999999996 111.173 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.403 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 11.9 tpp180 -58.77 -45.68 89.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.92 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -62.87 -44.51 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 70.209999999999994 110.869 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -64.52 -52.11 59.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 45.310000000000002 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.779 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.7 mp -60.9 -50.88 71.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 61.140000000000001 110.926 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.515 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.8 OUTLIER -64.7 -40.48 95.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.76 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 14' ' ' ARG . 5.1 t0 -55.73 -43.81 76.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.108 -0.496 . . . . 72.120000000000005 110.932 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.601 ' CE2' HG21 ' A' ' 46' ' ' THR . 1.2 t80 -60.48 -43.78 96.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 75.329999999999998 110.94 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.917 HG22 ' SD ' ' A' ' 101' ' ' MET . 4.6 mm -50.11 -45.31 23.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.111 -0.495 . . . . 53.329999999999998 111.144 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CG ' ' OD1' ' A' ' 117' ' ' ASN . 8.7 m-30 -65.08 -44.94 87.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 110.87 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.647 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -60.67 -28.95 68.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 73.319999999999993 110.871 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -88.33 -7.04 57.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 43.030000000000001 110.946 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.75 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -84.27 16.91 2.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.199 -0.455 . . . . 34.109999999999999 111.082 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.408 ' HD2' ' C ' ' A' ' 24' ' ' ALA . 2.3 mmm180 -111.56 112.65 24.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.294 -0.412 . . . . 74.319999999999993 110.875 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -38.7 158.33 0.1 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.603 0.716 . . . . 62.32 110.92 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -8.61 24.03 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.633 2.222 . . . . 74.329999999999998 112.343 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -95.64 6.01 50.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 54.200000000000003 110.846 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -144.55 137.91 14.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.543 0.687 . . . . 71.409999999999997 111.179 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 146.79 61.24 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.641 2.228 . . . . 74.439999999999998 112.323 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -95.28 168.35 11.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.665 0.745 . . . . 71.230000000000004 110.921 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 31' ' ' GLU . 52.6 Cg_endo -69.78 167.16 25.26 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.674 2.25 . . . . 74.409999999999997 112.38 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 170.16 17.18 Favored 'Trans proline' 0 N--CA 1.465 -0.182 0 C-N-CA 122.711 2.274 . . . . 74.150000000000006 112.357 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 174.73 8.99 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.687 2.258 . . . . 72.420000000000002 112.417 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.442 ' CG2' ' CZ ' ' A' ' 14' ' ' ARG . 1.4 m -106.86 -54.23 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.272 -0.422 . . . . 74.109999999999999 111.132 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 55.3 m -143.31 -173.86 4.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 61.509999999999998 110.773 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' H ' HG23 ' A' ' 37' ' ' VAL . 2.4 t -53.07 -54.67 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 64.519999999999996 111.045 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.929 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.1 pm0 -53.86 -36.65 62.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.219999999999999 110.848 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.528 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -73.69 -32.88 64.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.472 . . . . 65.239999999999995 111.171 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.445 ' CB ' HD21 ' A' ' 160' ' ' ASN . . . -70.3 -49.83 45.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 53.310000000000002 111.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.767 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -53.05 -53.91 43.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 73.129999999999995 110.934 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.688 ' CD1' HG12 ' A' ' 91' ' ' VAL . 0.1 OUTLIER -50.49 -47.21 57.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.93 179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -56.58 -26.64 55.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 73.25 110.886 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.1 m -90.21 -43.35 10.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 64.129999999999995 110.876 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.845 HG11 ' CD2' ' A' ' 158' ' ' PHE . 33.6 m -92.61 -54.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 111.145 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.669 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -51.37 -33.52 30.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 70.400000000000006 111.101 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.98 -33.81 75.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 74.140000000000001 110.829 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.597 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.56 -31.14 47.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.442 . . . . 72.400000000000006 110.887 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.597 HD13 ' HG3' ' A' ' 48' ' ' GLN . 12.0 mm -63.88 -32.84 58.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 62.140000000000001 111.138 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 3.5 mt-30 -80.77 -61.5 1.95 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 65.129999999999995 110.935 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -48.28 -19.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 110.939 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.57 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 12.0 pt-20 -96.79 -41.31 8.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 110.944 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.617 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.0 m-70 -103.81 -44.65 5.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 64.310000000000002 110.915 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.36 -23.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 52.509999999999998 110.963 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.6 mt-10 -46.83 -32.38 3.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 72.219999999999999 110.932 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -103.75 -39.05 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 75.209999999999994 110.875 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.617 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 11.4 m-85 -53.25 -52.28 59.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 75.409999999999997 110.9 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 t -49.64 -41.74 43.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 30.440000000000001 110.808 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.1 m -56.77 -38.0 71.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.801 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -78.73 -36.34 43.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 75.230000000000004 110.816 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.496 ' O ' ' NE ' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -46.65 -32.09 3.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 55.009999999999998 110.871 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -122.23 33.43 5.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.895 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.418 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 20.5 t -109.23 -68.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.136 -0.484 . . . . 63.210000000000001 110.861 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.6 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -103.69 -9.56 19.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 73.540000000000006 110.867 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.43 4.29 64.33 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 70.430000000000007 112.489 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.885 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -82.94 30.79 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.81 0.338 . . . . 73.129999999999995 110.884 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.811 ' O ' HD13 ' A' ' 100' ' ' LEU . 3.9 mpt_? -32.9 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.226 -0.443 . . . . 73.200000000000003 110.856 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.13 -51.37 10.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 74.310000000000002 110.906 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.494 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.8 mm-40 -47.74 -34.96 9.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 70.430000000000007 110.775 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.885 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -77.24 -38.0 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 72.0 110.924 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 1.026 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.2 -45.3 92.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 73.040000000000006 111.198 179.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.678 ' CB ' ' CE1' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.94 -43.38 62.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.102 -0.499 . . . . 72.120000000000005 110.897 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.494 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.4 mp0 -55.07 -50.54 68.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 74.120000000000005 110.889 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.711 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 6.3 mmm -57.35 -54.65 44.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.419 . . . . 73.219999999999999 110.867 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 1.102 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -51.54 -22.11 2.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.135 -0.484 . . . . 41.509999999999998 111.085 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -83.31 -28.45 29.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 72.450000000000003 110.826 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.903 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.2 ptpt -82.14 -48.33 11.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 65.319999999999993 110.928 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.92 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -82.38 -59.38 2.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 62.32 110.957 179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.92 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.7 154.03 21.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.420000000000002 110.836 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.0 -168.14 1.37 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 64.120000000000005 110.921 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -100.83 -53.53 3.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 72.519999999999996 110.898 179.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -13.33 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 65.219999999999999 110.867 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.614 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -82.61 127.39 33.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.319999999999993 110.926 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -66.13 72.26 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 63.439999999999998 110.823 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.797 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -53.12 118.02 3.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 70.219999999999999 110.889 -179.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.3 p -85.5 165.07 17.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 70.230000000000004 110.902 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.731 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -56.68 -39.63 74.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.922 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.2 t -56.55 -29.65 62.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 55.409999999999997 110.884 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.539 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.1 mm100 -72.82 -40.02 66.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 71.209999999999994 110.931 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.797 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.0 mm? -57.93 -56.9 16.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 53.030000000000001 110.93 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.712 HG11 ' CE1' ' A' ' 154' ' ' PHE . 15.5 m -58.95 -31.45 45.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 62.409999999999997 111.139 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.535 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.1 tmm? -61.3 -43.54 98.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 75.540000000000006 110.865 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.819 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.8 mt -58.0 -46.33 85.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.284 -0.417 . . . . 71.239999999999995 110.955 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.577 HD11 HD11 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -60.8 -34.52 74.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.896 179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.621 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -67.41 -59.12 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 72.430000000000007 111.098 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 1.032 ' CE2' HD11 ' A' ' 100' ' ' LEU . 68.7 t80 -55.02 -60.32 3.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.010000000000005 110.906 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.809 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.63 -50.29 1.6 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 73.420000000000002 111.128 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -66.94 -27.81 73.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.673 -0.775 . . . . 50.450000000000003 112.557 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.586 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -74.4 -27.91 60.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.85 0.357 . . . . 73.329999999999998 111.152 -179.883 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.032 HD11 ' CE2' ' A' ' 96' ' ' PHE . 7.0 mt -77.17 -35.76 55.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 54.329999999999998 110.958 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.917 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -32.73 105.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 72.450000000000003 110.908 179.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.469 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -88.74 157.44 18.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.253 -0.431 . . . . 72.219999999999999 110.876 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.75 ' NE2' ' HB1' ' A' ' 24' ' ' ALA . 21.8 mm-40 -140.14 150.57 44.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 74.200000000000003 110.98 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.412 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -178.42 54.56 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.73 -0.748 . . . . 63.219999999999999 112.434 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.491 ' HB3' ' NE ' ' A' ' 118' ' ' ARG . 54.0 Cg_endo -69.8 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.71 2.273 . . . . 75.209999999999994 112.334 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.8 p90 -124.74 -70.35 0.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 71.329999999999998 110.988 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.636 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.14 74.32 1.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 72.430000000000007 110.897 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.2 49.08 0.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 111.14 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.632 HG13 ' N ' ' A' ' 110' ' ' LYS . 7.3 p -114.43 -50.56 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 71.25 111.158 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.632 ' N ' HG13 ' A' ' 109' ' ' VAL . 19.8 ttpt -92.62 77.99 4.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.445 . . . . 74.25 110.917 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.568 ' OE1' HD11 ' A' ' 115' ' ' LEU . 41.0 mm-40 -134.84 118.32 16.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 60.32 110.842 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.458 ' O ' ' C ' ' A' ' 113' ' ' ARG . 12.7 mttm -75.84 49.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 73.549999999999997 110.902 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.458 ' C ' ' O ' ' A' ' 112' ' ' LYS . 20.9 ptt85 33.99 48.64 0.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 64.120000000000005 110.83 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.81 -51.82 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 63.539999999999999 110.885 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.77 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.3 OUTLIER -102.08 -17.05 16.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.888 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.77 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 35.03 -92.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 44.509999999999998 112.538 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 1.121 ' ND2' HG21 ' A' ' 121' ' ' VAL . 1.8 m120 -58.58 125.45 23.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.743 0.306 . . . . 71.349999999999994 110.962 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.549 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -53.85 -168.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 71.400000000000006 110.909 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.642 HG23 ' N ' ' A' ' 120' ' ' ILE . 26.9 m -79.12 -53.95 12.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 72.129999999999995 111.098 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.642 ' N ' HG23 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -50.12 -38.31 14.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.11 -0.496 . . . . 41.329999999999998 111.089 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 1.121 HG21 ' ND2' ' A' ' 117' ' ' ASN . 2.5 p -64.12 -47.04 91.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 54.399999999999999 111.134 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.474 ' CG2' ' O ' ' A' ' 119' ' ' VAL . 2.7 t -71.6 -32.27 67.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 111.113 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -76.27 -38.0 56.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 73.409999999999997 110.837 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.53 -34.71 58.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 63.109999999999999 110.867 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.673 ' O ' HG23 ' A' ' 129' ' ' VAL . 11.8 p -63.64 -45.59 89.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.230000000000004 110.912 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.466 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -62.37 -51.05 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 54.340000000000003 110.9 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.5 ' N ' ' CD1' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -65.55 -54.59 25.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 73.299999999999997 110.963 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 1.026 ' CG1' HG21 ' A' ' 71' ' ' VAL . 5.4 tt -56.71 -47.14 82.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 75.530000000000001 111.137 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.779 HG13 ' HB3' ' A' ' 16' ' ' LEU . 74.4 t -72.24 -33.74 47.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 70.439999999999998 111.167 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.46 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.75 -35.27 72.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 44.149999999999999 110.859 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.678 ' CE1' ' CB ' ' A' ' 72' ' ' LYS . 3.7 t80 -72.92 -55.24 6.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 54.149999999999999 110.909 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.809 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 2.1 mp -63.65 -55.02 26.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 110.894 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.569 ' CD1' ' HG3' ' A' ' 137' ' ' MET . 13.4 t80 -45.61 -48.42 14.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 63.25 110.889 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -66.55 -28.47 68.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.862 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 1.102 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 4.3 tp -57.54 -48.29 79.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.141 -0.481 . . . . 74.140000000000001 110.905 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.521 HD12 ' HE2' ' A' ' 137' ' ' MET . 2.4 pp -93.86 -21.51 19.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.271 -0.422 . . . . 72.230000000000004 110.904 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.569 ' HG3' ' CD1' ' A' ' 133' ' ' TYR . 11.8 mmt -84.06 23.94 0.99 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 71.430000000000007 110.918 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.43 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -96.82 152.14 20.03 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.747 -0.74 . . . . 42.310000000000002 112.447 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -46.97 42.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.829 0.347 . . . . 73.140000000000001 110.862 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.8 -59.28 2.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.902 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.55 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 47.6 m80 -55.73 -61.36 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.276 -0.42 . . . . 71.540000000000006 110.874 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.657 HH21 HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -45.72 -50.12 14.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 65.439999999999998 110.877 -179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 147' ' ' ALA . . . -49.66 -40.19 38.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 75.430000000000007 111.142 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -76.59 -51.85 10.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 71.510000000000005 110.916 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.827 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.51 -45.23 6.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 72.049999999999997 110.918 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.742 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.31 -32.41 33.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 73.519999999999996 110.892 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 143' ' ' ALA . . . -59.07 -14.64 10.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 73.109999999999999 111.103 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.731 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.24 23.36 14.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.409999999999997 110.921 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.12 0.42 57.18 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.643 -0.789 . . . . 43.509999999999998 112.45 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 48.73 -175.8 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.746 -0.74 . . . . 74.239999999999995 112.47 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.409 ' C ' ' O ' ' A' ' 150' ' ' GLY . 76.9 m95 -37.71 -27.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.734 0.302 . . . . 75.340000000000003 110.883 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 1.6 m-20 -64.95 -47.1 78.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.268 -0.423 . . . . 63.299999999999997 110.859 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.06 -27.63 73.51 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 64.140000000000001 112.509 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.712 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.0 t80 -67.27 -61.01 2.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.837 0.351 . . . . 71.120000000000005 110.872 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.767 ' HA ' HD23 ' A' ' 41' ' ' LEU . 29.0 p -51.5 -37.37 48.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 70.230000000000004 110.863 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.3 -26.76 42.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 73.120000000000005 110.91 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.464 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 1.5 t80 -70.31 -44.8 67.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 110.904 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.845 ' CD2' HG11 ' A' ' 45' ' ' VAL . 20.5 m-85 -86.8 -9.76 55.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 73.349999999999994 110.918 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.456 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 10.7 mmmt 63.09 72.12 0.49 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 110.946 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.885 HD22 HD12 ' A' ' 162' ' ' LEU . 2.0 t30 -48.29 145.89 5.03 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.562 0.696 . . . . 73.099999999999994 110.913 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.49 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.4 Cg_endo -69.74 -38.05 8.38 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.7 2.267 . . . . 74.0 112.352 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 1.088 HD13 ' O ' ' A' ' 162' ' ' LEU . 0.0 OUTLIER -58.21 158.02 15.21 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.62 0.724 . . . . 61.210000000000001 110.922 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.684 ' N ' HD22 ' A' ' 162' ' ' LEU . 53.7 Cg_endo -69.86 -88.94 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.635 2.224 . . . . 65.219999999999999 112.354 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.815 ' O ' HD21 ' A' ' 162' ' ' LEU . 0.3 OUTLIER -31.18 145.82 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.278 -0.419 . . . . 75.349999999999994 110.884 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.509 0 N-CA-C 110.266 -1.133 . . . . 74.140000000000001 110.266 179.928 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.521 ' N ' ' CD ' ' A' ' -4' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.278 -1.129 . . . . 73.030000000000001 110.278 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' -5' ' ' GLY . 53.1 Cg_endo -69.84 -10.61 28.91 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.68 2.253 . . . . 73.299999999999997 112.296 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' -4' ' ' PRO . 0.1 OUTLIER -34.32 -66.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 74.329999999999998 110.895 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 90.89 -174.44 39.13 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.716 -0.754 . . . . 43.530000000000001 112.513 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 p -124.88 162.24 24.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.83 0.348 . . . . 74.019999999999996 110.851 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tpp -72.62 -53.84 10.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.907 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -164.96 166.68 19.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 42.240000000000002 111.141 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.53 -37.52 0.84 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 74.230000000000004 110.831 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -63.85 -21.55 66.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 71.209999999999994 110.903 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.414 ' N ' ' OE1' ' A' ' 5' ' ' GLN . 15.4 mp0 -113.57 18.27 17.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 64.409999999999997 110.869 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -112.97 164.29 15.85 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.598 0.713 . . . . 73.310000000000002 110.838 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.739 2.292 . . . . 71.230000000000004 112.387 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.578 HD12 HH21 ' A' ' 142' ' ' ARG . 8.7 mt -64.78 -5.8 6.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.892 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -49.17 -76.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 73.150000000000006 110.871 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -66.71 -25.06 66.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 74.510000000000005 110.927 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 tpp85 -56.0 -43.77 78.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 73.510000000000005 110.911 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.611 HG21 HD11 ' A' ' 136' ' ' LEU . 98.1 m -77.06 -41.6 41.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 62.530000000000001 111.264 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' NH2' ' CE2' ' A' ' 133' ' ' TYR . 13.5 tpp180 -57.87 -49.74 75.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.836 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.486 ' HD2' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -65.82 -39.35 90.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 73.129999999999995 110.835 -179.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -65.57 -42.28 91.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.430000000000007 110.96 -179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.699 ' HB3' HG13 ' A' ' 129' ' ' VAL . 3.1 mp -73.44 -46.79 46.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 72.019999999999996 110.9 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.522 ' HA ' HG21 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -65.41 -46.73 78.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.255 -0.43 . . . . 65.129999999999995 110.819 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.83 -39.41 71.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.010000000000005 110.928 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' CE1' HG21 ' A' ' 46' ' ' THR . 65.7 t80 -59.94 -46.85 88.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.469 . . . . 63.340000000000003 110.981 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.631 HG22 ' HE3' ' A' ' 101' ' ' MET . 2.5 mm -51.39 -47.24 35.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 72.120000000000005 111.204 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 6.5 m-30 -58.01 -45.65 86.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 72.230000000000004 110.848 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.58 ' CZ ' ' HG2' ' A' ' 32' ' ' PRO . 4.5 m-85 -64.49 -53.8 42.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.119 -0.491 . . . . 74.030000000000001 110.92 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.52 -30.92 5.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 73.349999999999994 110.864 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -81.6 17.26 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 73.319999999999993 111.12 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.416 ' O ' ' NH1' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -64.33 111.91 2.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 110.878 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.39 151.28 60.38 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.579 0.704 . . . . 54.450000000000003 110.892 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -6.6 19.01 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.734 2.289 . . . . 70.239999999999995 112.334 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -99.93 5.72 45.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.199 -0.455 . . . . 73.209999999999994 110.841 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' HG23 ' A' ' 29' ' ' THR . 1.5 t -159.29 126.16 2.57 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.543 0.687 . . . . 74.209999999999994 111.14 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 143.49 50.76 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.694 2.263 . . . . 71.530000000000001 112.321 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -80.44 148.83 67.38 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.551 0.691 . . . . 63.329999999999998 110.957 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.58 ' HG2' ' CZ ' ' A' ' 22' ' ' PHE . 53.8 Cg_endo -69.75 171.3 14.71 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.66 2.24 . . . . 65.219999999999999 112.368 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 170.33 16.77 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.731 2.287 . . . . 42.310000000000002 112.3 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CG ' HD21 ' A' ' 162' ' ' LEU . 54.4 Cg_endo -69.71 158.62 56.39 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.681 2.254 . . . . 75.450000000000003 112.384 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.64 -50.96 4.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.27 -0.423 . . . . 62.409999999999997 111.15 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.418 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 67.0 m -122.7 164.11 18.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.883 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.0 t -50.59 -48.04 27.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 74.329999999999998 111.144 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' LEU . 1.5 pm0 -63.37 -30.86 71.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 55.32 110.819 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.18 -37.48 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 70.25 111.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 43' ' ' ARG . . . -74.27 -27.85 60.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.239999999999995 111.169 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.948 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.1 OUTLIER -65.65 -44.64 85.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 71.439999999999998 110.946 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.093 HD11 HD11 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.63 -55.73 21.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 72.230000000000004 110.95 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.488 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -52.49 -24.82 8.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.163 -0.472 . . . . 63.130000000000003 110.876 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 3.6 t -89.2 -49.57 6.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 73.040000000000006 110.8 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.586 HG23 ' N ' ' A' ' 46' ' ' THR . 3.0 m -91.67 -50.36 12.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.219999999999999 111.123 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.772 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.6 -35.46 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 65.519999999999996 111.168 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.07 -31.84 69.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 71.040000000000006 110.872 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.564 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -80.2 -33.84 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.91 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.485 ' N ' ' HG3' ' A' ' 48' ' ' GLN . 13.3 mm -62.04 -32.22 53.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.147 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.699 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -81.31 -61.86 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.457 . . . . 74.099999999999994 110.923 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -45.78 -20.66 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 110.929 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.583 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.2 pt-20 -97.48 -42.95 7.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.899 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.7 m-70 -101.2 -43.9 5.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.116 -0.493 . . . . 74.310000000000002 110.908 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.699 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -35.33 -27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.825 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.574 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.6 mt-10 -48.41 -41.62 29.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 72.319999999999993 110.943 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.5 -41.37 10.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 64.129999999999995 110.886 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 14.4 m-30 -53.31 -61.83 2.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.464 . . . . 70.030000000000001 110.917 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -58.49 -41.56 85.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.904 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 t -51.0 -41.29 59.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 72.519999999999996 110.897 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.8 OUTLIER -84.65 -42.27 15.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 71.420000000000002 110.848 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.1 t -41.76 -42.99 2.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 110.918 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -87.62 33.32 0.7 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.157 -0.474 . . . . 41.100000000000001 110.861 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' PHE . 10.8 t -110.18 -54.31 2.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.912 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HB2' ' CG ' ' A' ' 66' ' ' ASN . 0.0 OUTLIER -115.75 -21.45 9.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 71.239999999999995 110.875 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.69 10.58 72.68 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.725 -0.75 . . . . 62.140000000000001 112.493 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -82.98 31.71 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.838 0.351 . . . . 74.010000000000005 110.895 -179.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.66 -34.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 64.319999999999993 110.889 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.7 tp -75.79 -50.85 14.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 72.049999999999997 110.897 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 0.8 OUTLIER -50.79 -30.89 15.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.868 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.541 HD21 ' HE1' ' A' ' 60' ' ' PHE . 0.4 OUTLIER -80.54 -36.06 33.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.329999999999998 110.862 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.82 HG22 HD21 ' A' ' 132' ' ' LEU . 0.3 OUTLIER -63.11 -46.06 97.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 70.430000000000007 111.159 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.609 ' HE2' ' CE1' ' A' ' 131' ' ' PHE . 0.3 OUTLIER -73.35 -39.02 65.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.155 -0.475 . . . . 70.409999999999997 110.911 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.532 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.6 mp0 -61.78 -50.16 73.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 65.319999999999993 110.934 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.745 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 7.1 mmm -56.82 -55.63 31.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.907 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.877 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.61 -22.98 3.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 111.126 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.15 -26.9 30.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.236 -0.438 . . . . 61.439999999999998 110.875 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.932 ' HG2' HD23 ' A' ' 78' ' ' LEU . 7.5 ptpt -83.44 -48.98 9.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.158 -0.474 . . . . 62.009999999999998 110.923 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.932 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -81.54 -57.53 3.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.510000000000005 110.954 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -89.39 153.1 21.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 74.549999999999997 110.877 179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -166.21 -166.99 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 71.409999999999997 110.899 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -53.68 3.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 71.219999999999999 110.916 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -88.71 10.26 21.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 74.049999999999997 110.819 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -104.71 128.01 52.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.943 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 51.5 p-10 -67.04 71.82 0.1 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.150000000000006 110.847 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.837 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -59.57 123.32 16.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 75.040000000000006 110.895 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.58 157.03 16.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.88 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.694 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.7 m95 -48.91 -27.18 2.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 64.329999999999998 110.919 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.39 -35.11 79.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 63.240000000000002 110.882 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.52 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.6 mm100 -75.04 -36.97 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 75.140000000000001 110.927 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 ' CD2' ' A' ' 85' ' ' PHE . 3.3 mm? -57.37 -56.17 25.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 60.439999999999998 110.887 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.7 ' CG1' ' CE1' ' A' ' 154' ' ' PHE . 11.3 m -63.42 -32.26 55.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 63.450000000000003 111.145 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.448 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.8 tmm? -63.53 -42.04 98.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 74.310000000000002 110.904 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 1.09 HD11 HD22 ' A' ' 132' ' ' LEU . 0.5 OUTLIER -62.32 -38.43 89.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 70.409999999999997 110.961 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.792 HD13 HD13 ' A' ' 42' ' ' LEU . 10.4 mt -65.52 -48.69 71.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 73.019999999999996 110.902 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.772 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.47 -51.95 66.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 74.519999999999996 111.099 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 1.002 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.8 t80 -49.81 -59.65 3.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 110.893 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 1.064 ' HB2' HD11 ' A' ' 132' ' ' LEU . . . -41.79 -50.19 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.091 -0.504 . . . . 43.140000000000001 111.135 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.437 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -63.88 -25.52 69.31 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 12.23 112.489 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -77.87 -24.89 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.83 0.348 . . . . 63.32 111.126 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.002 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.0 mt -82.35 -35.09 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 74.409999999999997 110.879 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.631 ' HE3' HG22 ' A' ' 20' ' ' ILE . 11.0 tpp -32.36 99.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.197 -0.456 . . . . 72.129999999999995 110.916 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -72.24 152.37 42.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 65.239999999999995 110.863 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.466 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 75.6 mm-40 -150.52 131.68 14.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 61.439999999999998 110.954 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.558 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -154.5 46.02 0.55 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.738 -0.744 . . . . 53.409999999999997 112.527 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.558 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.6 Cg_endo -69.8 -163.47 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.708 2.272 . . . . 71.430000000000007 112.35 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.489 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.6 p90 -124.42 -67.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 74.129999999999995 110.881 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.712 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -131.09 73.37 1.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.487 . . . . 65.030000000000001 110.885 179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -75.06 58.01 0.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 72.420000000000002 111.075 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.633 HG13 ' N ' ' A' ' 110' ' ' LYS . 9.4 p -122.73 -51.04 2.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 55.399999999999999 111.058 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.633 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.3 mtmt -98.16 77.32 2.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.202 -0.454 . . . . 65.439999999999998 110.896 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.447 ' O ' ' N ' ' A' ' 113' ' ' ARG . 19.6 mm-40 -133.99 17.44 3.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 52.439999999999998 110.876 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 111' ' ' GLN . 9.7 tppt? 35.16 34.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 74.219999999999999 110.879 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 111' ' ' GLN . 0.5 OUTLIER 35.56 42.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 74.340000000000003 110.86 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' CG ' ' N ' ' A' ' 115' ' ' LEU . 0.6 OUTLIER -92.71 -54.38 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 52.240000000000002 110.899 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.572 HD23 ' H ' ' A' ' 115' ' ' LEU . 1.7 pt? -101.88 -16.91 16.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 75.439999999999998 110.89 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.413 ' O ' ' ND2' ' A' ' 117' ' ' ASN . . . 48.82 48.65 29.82 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 70.340000000000003 112.463 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER 40.18 47.33 2.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.808 0.337 . . . . 64.510000000000005 110.875 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.799 ' HA ' HG13 ' A' ' 121' ' ' VAL . 10.0 ptp180 -81.72 34.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 74.420000000000002 110.828 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.819 HG13 ' H ' ' A' ' 120' ' ' ILE . 1.2 p -77.67 -68.84 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 73.420000000000002 111.102 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.819 ' H ' HG13 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -86.53 -36.07 9.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 72.019999999999996 111.113 179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.799 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -58.99 -41.92 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 71.099999999999994 111.126 179.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.545 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.0 t -64.4 -48.32 75.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 62.119999999999997 111.166 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.545 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.32 -43.6 81.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.444 . . . . 75.150000000000006 110.892 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 128' ' ' ILE . 33.6 m-20 -73.53 -28.11 61.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 72.519999999999996 110.848 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 121' ' ' VAL . 8.9 t -71.27 -40.39 70.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.268 -0.424 . . . . 73.120000000000005 110.915 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.429 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 22.0 t -63.05 -51.34 67.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 75.200000000000003 110.987 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.48 -54.51 31.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 63.210000000000001 110.931 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.787 ' CG1' HG21 ' A' ' 71' ' ' VAL . 9.3 tt -55.59 -51.45 58.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 74.219999999999999 111.133 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.699 HG13 ' HB3' ' A' ' 16' ' ' LEU . 88.9 t -69.89 -32.37 51.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.150000000000006 111.078 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.531 HD22 ' N ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -49.66 -44.49 47.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 73.299999999999997 110.917 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.609 ' CE1' ' HE2' ' A' ' 72' ' ' LYS . 5.2 t80 -72.02 -55.52 7.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 1.09 HD22 HD11 ' A' ' 93' ' ' LEU . 3.4 mt -52.75 -55.38 23.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.1 -0.5 . . . . 75.409999999999997 110.884 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.549 ' CE2' ' NH2' ' A' ' 13' ' ' ARG . 3.6 t80 -46.24 -52.28 12.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 65.319999999999993 111.008 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.474 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -68.23 -28.71 67.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.079 -0.509 . . . . 54.420000000000002 110.85 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.877 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.79 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 72.409999999999997 110.873 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.611 HD11 HG21 ' A' ' 12' ' ' THR . 1.7 pp -89.23 -31.93 17.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 71.109999999999999 110.898 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.513 ' HE3' ' CD1' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -83.63 24.17 0.89 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 62.43 110.852 179.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.47 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -84.17 166.67 42.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.719 -0.753 . . . . 74.150000000000006 112.473 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -53.43 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.795 0.331 . . . . 71.430000000000007 110.884 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.497 ' CD ' ' C ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -78.21 -39.57 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.863 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.552 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 20.2 m80 -66.03 -60.1 3.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.798 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.578 HH21 HD12 ' A' ' 8' ' ' LEU . 2.7 tmt_? -52.18 -47.32 65.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.540000000000006 110.858 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.97 -41.58 59.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.192 -0.458 . . . . 35.450000000000003 111.115 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' HD2' HD23 ' A' ' 148' ' ' LEU . 0.0 OUTLIER -77.09 -48.84 16.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 73.510000000000005 110.888 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.47 -44.33 5.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 74.319999999999993 110.846 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.701 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -80.83 -31.12 35.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.450000000000003 110.885 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.469 ' HB3' ' HD3' ' A' ' 144' ' ' ARG . . . -56.65 -14.96 3.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.117 -0.492 . . . . 75.019999999999996 111.135 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.694 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.94 22.77 14.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.224 -0.444 . . . . 63.140000000000001 110.953 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 98.78 0.34 57.65 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.68 -0.771 . . . . 53.530000000000001 112.463 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.04 -175.18 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.723 -0.751 . . . . 73.310000000000002 112.517 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 150' ' ' GLY . 73.6 m95 -37.93 -27.39 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.798 0.332 . . . . 71.530000000000001 110.953 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.503 ' N ' ' O ' ' A' ' 150' ' ' GLY . 4.3 t0 -62.66 -47.84 81.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.856 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -68.97 -29.82 72.38 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 62.229999999999997 112.522 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.715 ' CZ ' HD12 ' A' ' 41' ' ' LEU . 2.4 t80 -67.48 -56.64 8.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 74.530000000000001 110.838 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.492 ' HA ' ' CD2' ' A' ' 41' ' ' LEU . 14.7 p -51.96 -40.11 60.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 53.210000000000001 110.87 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.578 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.25 -26.99 42.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 64.409999999999997 110.851 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.428 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 8.2 t80 -67.43 -43.63 80.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 63.43 110.867 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.948 ' HB2' HD11 ' A' ' 41' ' ' LEU . 44.0 m-85 -90.5 -15.64 30.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 74.420000000000002 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 7.1 mmmt 64.68 77.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 110.926 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.512 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.5 148.68 3.3 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.668 0.747 . . . . 73.010000000000005 110.874 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.464 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.6 Cg_endo -69.78 -38.63 7.49 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.698 2.265 . . . . 72.109999999999999 112.391 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.512 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 3.2 mp -58.81 143.88 82.07 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 54.229999999999997 110.892 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -50.93 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.736 2.29 . . . . 73.540000000000006 112.383 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.5 mp -82.15 156.71 24.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.216 -0.447 . . . . 32.43 110.903 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.296 -1.122 . . . . 60.43 110.296 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.522 0 N-CA-C 110.308 -1.117 . . . . 74.129999999999995 110.308 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -4.91 14.98 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.682 2.255 . . . . 72.120000000000005 112.293 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.882 HD23 ' O ' ' A' ' -3' ' ' LEU . 0.1 OUTLIER -48.84 171.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 74.340000000000003 110.871 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 139.17 165.31 10.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.695 -0.764 . . . . 70.349999999999994 112.51 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.1 m -159.79 137.94 10.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.841 0.353 . . . . 64.329999999999998 110.832 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.403 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 19.1 ptm -81.14 -52.91 6.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.123 -0.489 . . . . 63.32 110.879 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.403 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -135.23 169.88 16.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 111.114 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -138.23 4.7 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 70.129999999999995 110.883 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.5 m -130.54 7.47 4.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 71.530000000000001 110.89 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -100.3 -15.49 18.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 75.530000000000001 110.889 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.426 ' HB2' ' NH2' ' A' ' 11' ' ' ARG . 2.1 m-20 -113.11 163.74 17.32 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.711 . . . . 73.129999999999995 110.889 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.491 ' HG2' ' CD2' ' A' ' 9' ' ' HIS . 54.1 Cg_endo -69.66 -163.68 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.707 2.271 . . . . 63.409999999999997 112.351 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.9 tp -99.37 -9.48 23.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 72.219999999999999 110.927 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.667 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -69.88 -55.52 9.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 73.329999999999998 110.87 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.667 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 2.6 pt-20 -74.72 -15.62 60.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.44 . . . . 75.299999999999997 110.804 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' HD3' ' NH1' ' A' ' 14' ' ' ARG . 35.9 mmt-85 -75.19 -35.34 61.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 75.209999999999994 110.914 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.823 HG21 HD11 ' A' ' 136' ' ' LEU . 21.7 m -77.19 -54.36 6.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 63.109999999999999 111.109 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -49.52 -49.92 43.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 72.109999999999999 110.874 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.15 -44.69 91.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 71.510000000000005 110.803 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.788 HD11 ' CD1' ' A' ' 42' ' ' LEU . 0.1 OUTLIER -58.33 -53.11 62.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 74.319999999999993 110.887 -179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.828 ' HB3' HG13 ' A' ' 129' ' ' VAL . 0.9 OUTLIER -53.29 -55.42 24.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 74.510000000000005 110.932 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.474 ' HA ' HG13 ' A' ' 20' ' ' ILE . 25.5 m -58.9 -28.37 66.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 72.5 110.889 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -58.97 -46.47 88.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.148 -0.478 . . . . 71.439999999999998 110.885 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.775 ' CE1' HD13 ' A' ' 20' ' ' ILE . 2.4 p90 -72.61 -19.26 61.5 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.184 -0.462 . . . . 64.340000000000003 110.947 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.839 HG22 ' SD ' ' A' ' 101' ' ' MET . 17.2 mm -67.23 -43.33 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.039 -0.528 . . . . 74.430000000000007 111.137 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CE1' ' CG2' ' A' ' 121' ' ' VAL . 9.2 m-30 -71.29 -45.5 62.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 63.200000000000003 110.842 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.496 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -55.53 -28.92 57.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 74.129999999999995 110.903 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.455 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -83.98 -19.94 33.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.84 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.632 ' HB2' ' HG2' ' A' ' 101' ' ' MET . . . -80.86 15.88 1.64 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.282 -0.417 . . . . 25.440000000000001 111.131 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.11 112.56 24.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 72.109999999999999 110.941 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -44.18 156.5 0.32 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.689 0.756 . . . . 71.040000000000006 110.834 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 -10.35 28.34 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.713 2.275 . . . . 72.310000000000002 112.352 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -91.37 5.74 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 110.923 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 t -139.56 140.78 26.26 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.556 0.693 . . . . 33.210000000000001 111.125 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.78 136.68 33.57 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.74 2.293 . . . . 73.409999999999997 112.391 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.466 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -84.05 157.94 62.21 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.651 0.739 . . . . 71.230000000000004 110.852 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 169.19 19.5 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.728 2.285 . . . . 65.129999999999995 112.31 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.406 ' HG2' HD11 ' A' ' -3' ' ' LEU . 53.1 Cg_endo -69.74 170.15 17.24 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.714 2.276 . . . . 71.409999999999997 112.303 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 171.36 14.67 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.662 2.242 . . . . 64.510000000000005 112.334 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.443 ' CG2' ' NE ' ' A' ' 14' ' ' ARG . 1.4 m -106.03 -48.38 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.232 -0.44 . . . . 54.210000000000001 111.11 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.591 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -142.0 -175.32 4.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 74.329999999999998 110.822 -179.805 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.04 -49.6 84.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 75.109999999999999 111.099 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.4 pm0 -62.26 -33.59 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.14 -0.482 . . . . 72.340000000000003 110.962 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.591 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.84 -21.98 60.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 74.140000000000001 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.33 -52.29 16.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.426 . . . . 71.209999999999994 111.087 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.981 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -57.69 -54.53 45.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 72.010000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.085 HD23 HG12 ' A' ' 91' ' ' VAL . 10.4 mt -49.3 -45.22 44.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 62.219999999999999 110.912 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.469 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -59.42 -27.22 65.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.120000000000005 110.872 179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -88.9 -40.67 12.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 73.549999999999997 110.803 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.651 HG23 ' N ' ' A' ' 46' ' ' THR . 29.7 m -89.88 -55.94 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 60.130000000000003 111.095 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.651 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.62 -35.43 30.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.161 -0.472 . . . . 74.319999999999993 111.138 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.498 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.43 -30.97 72.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 63.210000000000001 110.856 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.514 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.37 -33.67 37.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 110.963 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.514 HD13 ' HG3' ' A' ' 48' ' ' GLN . 11.8 mm -62.84 -29.99 48.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.098 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.709 ' O ' ' N ' ' A' ' 54' ' ' GLN . 4.3 mt-30 -80.58 -60.04 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.219 -0.446 . . . . 70.109999999999999 110.874 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -50.11 -19.24 0.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.439999999999998 110.836 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.497 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 9.0 pt-20 -96.2 -41.37 8.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.261 -0.427 . . . . 73.519999999999996 110.877 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.611 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 90.3 m-70 -103.9 -44.3 5.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 74.340000000000003 110.831 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.709 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.16 -23.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.427 . . . . 74.319999999999993 110.924 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -46.06 -31.97 2.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 62.200000000000003 110.89 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -102.29 -40.88 6.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 71.120000000000005 110.835 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.611 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 5.3 m-30 -53.3 -50.92 63.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 74.329999999999998 110.914 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' SG ' ' A' ' 61' ' ' CYS . 1.2 t -49.93 -46.5 52.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.109999999999999 110.816 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 47.2 t -51.9 -39.31 58.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 35.409999999999997 110.88 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HA ' ' CB ' ' A' ' 63' ' ' SER . 89.4 m-85 -78.74 -30.47 45.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.86 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.498 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.5 OUTLIER -43.62 -44.33 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.112 -0.495 . . . . 60.149999999999999 110.873 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.498 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 0.4 OUTLIER -115.16 33.15 5.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.94 -179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 60' ' ' PHE . 24.2 t -103.81 -68.03 0.86 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 50.5 110.922 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.485 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 41.0 mmm-85 -101.8 -12.67 18.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 110.908 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.25 4.11 72.45 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.753 -0.737 . . . . 50.030000000000001 112.491 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.512 ' ND2' ' N ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -84.14 30.76 0.51 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 73.219999999999999 110.839 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.787 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.05 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 73.349999999999994 110.843 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.2 tp -78.82 -51.26 9.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 64.200000000000003 110.879 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.51 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 73.0 mm-40 -50.9 -32.55 20.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 75.120000000000005 110.862 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 70' ' ' LEU . 2.2 mt -77.99 -36.91 48.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 61.43 110.883 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.915 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -60.25 -45.65 95.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 111.185 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.69 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.6 ptpt -72.75 -44.12 62.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.124 -0.489 . . . . 74.420000000000002 110.94 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.19 -50.09 70.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 72.209999999999994 110.931 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.726 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 8.9 mmm -57.98 -55.89 29.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.218 -0.446 . . . . 75.019999999999996 110.96 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.866 ' HB1' ' CD2' ' A' ' 135' ' ' LEU . . . -52.86 -19.37 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 71.030000000000001 111.097 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.43 -40.53 43.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.881 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.85 ' HG3' HD23 ' A' ' 78' ' ' LEU . 9.7 ptpt -72.19 -47.74 48.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 72.140000000000001 110.884 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.919 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -80.19 -63.59 1.38 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 62.119999999999997 110.871 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -85.42 154.96 21.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.191 -0.459 . . . . 60.140000000000001 110.886 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.401 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -166.68 -172.99 2.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 73.25 110.911 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.477 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.68 -43.89 6.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 110.906 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -93.18 -12.77 29.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.824 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.607 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.92 127.8 35.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 72.109999999999999 110.912 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.446 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 13.5 p-10 -66.41 72.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.030000000000001 110.934 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.788 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.15 127.28 18.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 62.240000000000002 110.874 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.89 158.59 15.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 110.896 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.725 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.6 m95 -51.13 -32.37 22.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.165 -0.47 . . . . 72.409999999999997 110.945 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.3 t -61.99 -33.25 73.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 75.099999999999994 110.827 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.513 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.6 mm100 -73.83 -41.67 61.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 44.210000000000001 110.922 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.788 HD21 ' CE2' ' A' ' 85' ' ' PHE . 4.2 mm? -50.75 -55.29 17.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 75.5 110.912 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 1.085 HG12 HD23 ' A' ' 42' ' ' LEU . 12.3 m -67.02 -30.72 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 72.310000000000002 111.087 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.4 ' SD ' ' O ' ' A' ' 92' ' ' MET . 1.4 tmm? -61.57 -43.54 98.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.230000000000004 110.856 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -65.06 -35.53 81.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 62.020000000000003 110.882 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.93 HD23 HD13 ' A' ' 42' ' ' LEU . 1.5 mp -66.08 -42.31 89.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.863 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -62.36 -58.23 8.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.257 -0.429 . . . . 61.049999999999997 111.067 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.958 ' CE2' HD11 ' A' ' 100' ' ' LEU . 72.3 t80 -48.09 -60.68 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.238 -0.437 . . . . 53.149999999999999 110.845 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.859 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -39.81 -53.75 2.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.149 -0.478 . . . . 61.140000000000001 111.087 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.455 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -58.52 -32.05 68.07 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.741 -0.742 . . . . 74.5 112.479 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.818 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.7 OUTLIER -71.16 -22.74 62.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.879 0.371 . . . . 75.109999999999999 111.107 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.958 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.8 mt -85.15 -34.04 22.21 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.279 -0.419 . . . . 72.540000000000006 110.885 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.839 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -33.77 103.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 74.140000000000001 110.896 179.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -81.33 134.84 35.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 64.120000000000005 110.854 -179.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -119.36 116.53 26.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 73.129999999999995 110.894 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.532 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -163.14 47.48 0.32 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.748 -0.739 . . . . 74.040000000000006 112.496 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.81 -162.85 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.631 2.22 . . . . 72.040000000000006 112.389 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.537 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.5 t80 -124.04 -13.35 7.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.010000000000005 110.947 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.631 ' SD ' HD12 ' A' ' 115' ' ' LEU . 22.5 mmt -36.84 95.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 72.230000000000004 110.876 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.481 ' N ' ' HG3' ' A' ' 111' ' ' GLN . . . -92.76 -149.57 0.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.310000000000002 111.043 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.817 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.56 -84.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.164 -0.471 . . . . 72.420000000000002 111.098 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.817 ' N ' HG22 ' A' ' 109' ' ' VAL . 20.2 ttpt -66.66 87.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.429 . . . . 74.530000000000001 110.949 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' A' ' 108' ' ' ALA . 13.4 mm-40 -142.44 150.46 40.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 74.430000000000007 110.874 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 167.96 1.4 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 62.119999999999997 110.88 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 23.5 tpt85 -107.82 -11.81 15.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 74.340000000000003 110.855 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.416 ' OD1' HD23 ' A' ' 115' ' ' LEU . 0.6 OUTLIER -87.18 0.95 54.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.859 -179.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.631 HD12 ' SD ' ' A' ' 107' ' ' MET . 0.5 OUTLIER -76.39 -63.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 64.239999999999995 110.895 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 118' ' ' ARG . . . 76.8 27.17 61.18 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 73.420000000000002 112.496 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.514 ' O ' ' CG1' ' A' ' 121' ' ' VAL . 4.8 p-10 40.33 27.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.826 0.346 . . . . 72.099999999999994 110.894 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' A' ' 121' ' ' VAL . 5.8 ptt180 -80.8 32.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 62.350000000000001 110.827 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.621 HG22 ' N ' ' A' ' 120' ' ' ILE . 0.1 OUTLIER -78.95 -66.45 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.540000000000006 111.122 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.768 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.2 OUTLIER -85.56 -40.04 14.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.233 -0.44 . . . . 72.239999999999995 111.054 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.768 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.1 OUTLIER -56.31 -46.52 81.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 75.230000000000004 111.167 179.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 123' ' ' ARG . 5.8 t -57.35 -49.14 77.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 72.5 111.112 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.573 ' N ' HG23 ' A' ' 122' ' ' THR . 4.3 ptm85 -66.18 -41.18 90.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.251 -0.431 . . . . 72.109999999999999 110.846 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -69.5 -32.2 70.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.459 . . . . 72.310000000000002 110.849 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.815 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.3 p -71.83 -44.83 63.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 71.049999999999997 110.928 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.5 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 12.0 p -60.09 -39.59 86.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.128 -0.487 . . . . 72.129999999999995 110.87 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 61.2 mt -75.4 -54.82 6.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.243 -0.435 . . . . 75.239999999999995 110.926 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.915 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -57.31 -46.22 85.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 54.439999999999998 111.108 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.828 HG13 ' HB3' ' A' ' 16' ' ' LEU . 24.1 t -71.23 -33.65 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.132 -0.486 . . . . 53.130000000000003 111.122 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' A' ' 126' ' ' CYS . 0.6 OUTLIER -55.58 -37.31 67.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.917 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.69 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.4 t80 -73.23 -55.23 6.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.888 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.859 HD21 ' HB2' ' A' ' 97' ' ' ALA . 2.0 mp -61.41 -55.88 26.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.112 -0.495 . . . . 72.439999999999998 110.996 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.635 ' O ' HD13 ' A' ' 136' ' ' LEU . 11.8 t80 -47.24 -56.83 5.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 73.450000000000003 110.905 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -61.13 -28.67 69.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 74.109999999999999 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.866 ' CD2' ' HB1' ' A' ' 75' ' ' ALA . 3.4 tp -62.05 -53.6 53.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.896 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.972 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -89.84 -14.52 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.9 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.885 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -94.78 24.17 4.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 71.450000000000003 110.882 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -91.9 159.13 25.42 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.723 -0.751 . . . . 71.519999999999996 112.459 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -51.0 -47.64 61.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.751 0.31 . . . . 65.439999999999998 110.937 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.477 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -74.96 -57.89 3.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 72.409999999999997 110.888 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.554 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 35.7 m-70 -55.73 -61.47 2.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 75.140000000000001 110.864 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.481 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -46.32 -51.14 15.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.839 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.93 -39.64 40.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.549999999999997 111.103 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -76.6 -52.01 10.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 70.239999999999995 110.873 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.843 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.37 -44.45 5.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 71.430000000000007 110.868 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.726 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.09 -30.31 34.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.911 179.942 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.73 -14.64 22.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 111.115 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.725 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.2 23.73 13.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.27 -0.423 . . . . 74.219999999999999 110.867 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.07 1.28 57.11 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.818 -0.706 . . . . 40.439999999999998 112.508 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 47.36 -174.34 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 75.120000000000005 112.474 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -38.09 -26.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.736 0.303 . . . . 74.209999999999994 110.88 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' N ' ' O ' ' A' ' 150' ' ' GLY . 3.0 t70 -64.45 -47.51 78.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.285 -0.416 . . . . 74.430000000000007 110.85 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -67.68 -27.47 73.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.734 -0.746 . . . . 71.109999999999999 112.508 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.61 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 4.4 t80 -67.46 -60.4 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.77 0.319 . . . . 61.119999999999997 110.858 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.829 ' HA ' HD23 ' A' ' 41' ' ' LEU . 6.0 m -51.36 -37.61 48.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.465 . . . . 62.509999999999998 110.887 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.57 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.84 -26.74 40.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 74.329999999999998 110.874 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.451 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.1 t80 -69.82 -44.67 69.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 64.040000000000006 110.929 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.467 ' CB ' HD11 ' A' ' 41' ' ' LEU . 27.3 m-85 -94.34 0.23 55.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 64.030000000000001 110.888 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 159' ' ' LYS . 0.0 OUTLIER 58.38 80.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 65.319999999999993 110.917 179.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.981 ' HA ' HD22 ' A' ' 41' ' ' LEU . 4.5 t30 -48.58 140.17 10.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.632 0.73 . . . . 60.210000000000001 110.878 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 53.3 Cg_endo -69.74 -37.24 9.49 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.731 2.288 . . . . 43.0 112.361 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.445 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 3.9 mp -94.02 162.0 28.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.558 0.694 . . . . 60.310000000000002 110.954 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -90.41 0.0 OUTLIER 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.629 2.22 . . . . 75.030000000000001 112.408 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 165' ' ' GLY . 4.7 mp -115.4 179.28 4.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.329999999999998 110.902 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.335 0.51 0 N-CA-C 110.28 -1.128 . . . . 45.210000000000001 110.28 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.443 ' N ' ' OD2' ' A' ' 152' ' ' ASP . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.282 -1.127 . . . . 24.41 110.282 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 1.11 4.73 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.627 2.218 . . . . 53.340000000000003 112.404 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.434 ' CD2' ' C ' ' A' ' -3' ' ' LEU . 0.5 OUTLIER -67.61 85.22 0.19 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 71.430000000000007 110.857 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 114.73 115.58 3.09 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.66 -0.781 . . . . 61.299999999999997 112.49 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.3 t -122.4 75.55 1.25 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.888 0.375 . . . . 45.229999999999997 110.824 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HG2' ' N ' ' A' ' 2' ' ' ALA . 1.1 pmm? -56.18 -33.99 65.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 61.420000000000002 110.899 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 5' ' ' GLN . . . -166.51 176.97 6.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 64.420000000000002 111.094 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -111.93 -18.96 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 65.140000000000001 110.927 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.6 t -127.45 5.27 6.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 75.400000000000006 110.848 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.747 ' HB2' ' HB3' ' A' ' 2' ' ' ALA . 49.1 mm-40 -99.73 9.74 42.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 73.239999999999995 110.925 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.46 144.24 29.1 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.58 0.705 . . . . 74.109999999999999 110.89 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.728 2.285 . . . . 73.329999999999998 112.392 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.05 -18.99 65.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.949 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.641 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 3.3 p80 -66.09 -54.63 23.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.485 . . . . 63.350000000000001 110.837 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.641 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 25.9 tt0 -66.36 -21.05 66.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.109 -0.496 . . . . 71.140000000000001 110.84 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -30.36 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 110.897 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -74.49 -54.24 7.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 111.177 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.592 ' HB2' ' CE2' ' A' ' 133' ' ' TYR . 9.6 tpp180 -52.84 -54.63 31.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 71.439999999999998 110.951 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.48 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.11 -45.44 75.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 110.871 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.73 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -59.77 -52.71 64.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 75.239999999999995 110.906 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.863 HD11 HD11 ' A' ' 94' ' ' LEU . 6.1 mp -59.02 -53.13 61.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 54.229999999999997 110.923 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.99 -38.55 70.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 72.120000000000005 110.901 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.546 ' CG ' ' CG2' ' A' ' 35' ' ' THR . 0.1 OUTLIER -57.44 -35.76 70.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.117 -0.492 . . . . 64.319999999999993 110.896 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.718 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.5 t80 -75.09 -22.67 58.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 71.109999999999999 110.93 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.803 HG22 ' SD ' ' A' ' 101' ' ' MET . 7.3 mm -68.53 -45.26 82.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 65.299999999999997 111.138 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -67.07 -50.03 63.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.420000000000002 110.849 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.644 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -28.57 57.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 70.219999999999999 110.866 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -13.55 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 73.109999999999999 110.859 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.694 ' HB2' ' SD ' ' A' ' 101' ' ' MET . . . -87.75 17.28 4.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 51.439999999999998 111.103 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' A' ' 26' ' ' GLU . 87.2 mtt-85 -108.21 112.78 25.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 75.030000000000001 110.876 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 25' ' ' ARG . 13.3 mt-10 -33.5 147.28 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 121.697 0.76 . . . . 64.129999999999995 110.875 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -16.73 37.63 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.741 2.294 . . . . 70.430000000000007 112.307 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -78.95 5.68 11.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 110.856 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -144.31 141.02 17.41 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.612 0.72 . . . . 74.329999999999998 111.144 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 136.62 33.4 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.671 2.247 . . . . 63.009999999999998 112.36 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.572 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -84.92 158.35 59.06 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 75.319999999999993 110.872 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HD3' ' NE ' ' A' ' 25' ' ' ARG . 53.6 Cg_endo -69.8 170.12 17.36 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.645 2.23 . . . . 70.519999999999996 112.419 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.7 170.41 16.56 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.738 2.292 . . . . 71.400000000000006 112.333 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 -170.96 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.702 2.268 . . . . 61.340000000000003 112.383 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.546 ' CG2' ' CG ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -123.13 -39.93 2.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 64.200000000000003 111.21 -179.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.512 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 19.1 m -137.81 177.38 7.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 43.119999999999997 110.816 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -57.22 -47.03 84.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.468 . . . . 64.340000000000003 111.06 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.73 ' CG ' HD22 ' A' ' 15' ' ' LEU . 20.4 pt-20 -63.14 -33.46 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 64.439999999999998 110.86 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.512 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.74 -27.77 63.22 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 71.120000000000005 111.102 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.68 -44.09 57.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 55.43 111.098 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -56.43 -55.37 34.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.183 -0.462 . . . . 62.350000000000001 110.912 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.21 -47.9 65.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 63.329999999999998 110.945 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -53.61 -27.1 24.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.165 -0.47 . . . . 65.129999999999995 110.819 179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.08 -44.23 9.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.236 -0.438 . . . . 74.400000000000006 110.844 -179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.678 HG23 ' N ' ' A' ' 46' ' ' THR . 33.7 m -92.31 -54.64 7.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.153 -0.476 . . . . 54.310000000000002 111.111 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.718 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.3 -32.94 18.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.168 -0.469 . . . . 65.439999999999998 111.135 -179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -64.77 -33.26 75.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.863 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.543 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.04 -30.32 49.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 64.540000000000006 110.924 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.56 HG21 ' HG2' ' A' ' 92' ' ' MET . 13.2 mm -65.31 -35.0 74.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 74.150000000000006 111.077 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 54' ' ' GLN . 1.7 mt-30 -81.42 -62.22 1.71 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 75.340000000000003 110.954 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.37 -20.95 0.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 73.0 110.908 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.584 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.8 pt-20 -97.42 -42.97 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.903 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.64 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.4 m-70 -101.39 -43.69 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 74.209999999999994 110.863 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.7 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -33.03 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.199 -0.455 . . . . 64.200000000000003 110.91 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.597 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.8 mt-10 -48.39 -44.77 35.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 61.210000000000001 110.884 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -88.98 -41.75 12.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 73.219999999999999 110.87 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.64 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.9 m-30 -53.0 -61.84 2.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 54.219999999999999 110.923 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.2 t -60.9 -38.55 86.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.162 -0.472 . . . . 50.340000000000003 110.796 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.5 t -50.55 -39.64 49.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.420000000000002 110.843 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 1.072 ' CD1' HD21 ' A' ' 70' ' ' LEU . 1.3 t80 -85.44 -41.93 14.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 70.150000000000006 110.914 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.0 OUTLIER -41.17 -40.68 1.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 61.200000000000003 110.855 -179.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.423 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 26.1 pt-20 -90.31 33.32 0.9 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.871 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 60' ' ' PHE . 46.9 m -118.07 -64.91 1.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.856 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 64' ' ' ARG . 6.6 mpt_? -96.67 -23.12 16.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.92 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 83.93 3.72 89.04 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.729 -0.748 . . . . 75.150000000000006 112.538 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -81.8 31.25 0.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.75 0.31 . . . . 74.209999999999994 110.866 -179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.693 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -33.25 -34.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 74.019999999999996 110.844 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 66' ' ' ASN . 3.5 tp -78.07 -51.94 9.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.433 . . . . 73.329999999999998 110.947 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.543 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 1.6 mp0 -47.28 -36.35 9.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.439999999999998 110.926 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 1.072 HD21 ' CD1' ' A' ' 60' ' ' PHE . 4.0 mp -75.56 -37.65 59.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 54.420000000000002 110.871 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.985 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -55.49 -48.29 77.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.274 -0.421 . . . . 60.420000000000002 111.12 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.615 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -73.81 -42.95 60.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 110.866 179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 1.7 mp0 -54.55 -48.38 72.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 110.941 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.604 ' CE ' ' CD1' ' A' ' 96' ' ' PHE . 8.0 mmm -58.81 -53.75 54.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.906 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.624 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.37 -22.28 2.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.103 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.3 -29.99 27.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.268 -0.424 . . . . 75.219999999999999 110.848 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.906 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.6 ptpt -79.69 -48.28 13.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 74.019999999999996 110.891 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.91 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -83.02 -60.29 2.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 74.209999999999994 110.98 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.91 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.41 155.12 20.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 65.200000000000003 110.898 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -163.38 -159.14 0.5 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 63.399999999999999 110.873 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.485 ' HB3' ' NE ' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -101.08 -66.75 0.89 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.828 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.404 ' CG ' ' NE2' ' A' ' 83' ' ' GLN . 3.0 p-10 -75.29 -18.86 59.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 65.299999999999997 110.887 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.759 HE21 ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -64.47 133.84 53.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 55.140000000000001 110.905 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.91 55.03 0.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.121 -0.491 . . . . 71.519999999999996 110.837 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.799 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.46 125.29 4.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.019999999999996 110.901 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.0 t -95.09 175.46 6.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 70.019999999999996 110.887 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 1.087 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -65.14 -22.28 66.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 72.420000000000002 110.912 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 49.6 m -70.77 -33.59 70.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.209 -0.45 . . . . 70.400000000000006 110.891 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.516 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 7.7 mm100 -75.34 -34.83 61.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.104 -0.498 . . . . 75.430000000000007 110.924 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.087 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.6 mt -62.83 -55.7 23.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.271 -0.422 . . . . 72.239999999999995 110.951 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.718 HG11 ' CE1' ' A' ' 154' ' ' PHE . 27.4 m -62.11 -31.08 50.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 72.109999999999999 111.184 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.56 ' HG2' HG21 ' A' ' 49' ' ' ILE . 3.2 tmm? -61.53 -44.74 96.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 74.25 110.871 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.56 ' CD2' HD11 ' A' ' 78' ' ' LEU . 8.1 mt -58.17 -46.42 85.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 63.43 110.94 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -54.63 -45.19 73.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 73.200000000000003 110.946 179.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.565 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -62.22 -55.18 31.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.109999999999999 111.129 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.996 ' CE2' HD11 ' A' ' 100' ' ' LEU . 60.7 t80 -50.65 -60.6 2.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 64.129999999999995 110.874 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.81 -49.39 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 63.049999999999997 111.092 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.92 -27.39 73.67 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.703 -0.76 . . . . 63.329999999999998 112.506 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.671 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.99 -27.01 61.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.765 0.317 . . . . 51.43 111.169 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.996 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.1 mt -83.7 -32.1 25.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.857 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.803 ' SD ' HG22 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -31.23 106.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.238 -0.437 . . . . 70.299999999999997 110.904 179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.516 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -88.98 136.82 32.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.961 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 103' ' ' GLN . 5.9 mm100 -142.68 126.99 17.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.251 -0.431 . . . . 74.349999999999994 110.918 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.69 46.63 0.67 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.696 -0.764 . . . . 64.439999999999998 112.428 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 54.2 Cg_endo -69.83 -161.68 0.08 OUTLIER 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.629 2.219 . . . . 63.409999999999997 112.383 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.624 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -93.29 4.02 54.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 60.329999999999998 110.941 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.608 ' SD ' ' N ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -35.89 91.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 62.020000000000003 110.831 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.85 -154.34 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 72.340000000000003 111.166 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.856 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -67.68 -85.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.428 . . . . 61.329999999999998 111.118 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.856 ' N ' HG22 ' A' ' 109' ' ' VAL . 12.7 mtmt -68.83 94.28 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.162 -0.472 . . . . 75.150000000000006 110.914 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -138.86 -172.11 3.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 54.340000000000003 110.979 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.7 175.23 10.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 63.229999999999997 110.879 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.29 55.31 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.277 -0.419 . . . . 70.430000000000007 110.904 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -97.03 -55.0 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 75.209999999999994 110.846 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -77.87 -16.11 58.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 72.439999999999998 110.891 -179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.564 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 45.26 92.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 62.140000000000001 112.528 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.447 ' C ' ' O ' ' A' ' 116' ' ' GLY . 49.5 t30 -34.69 112.35 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.769 0.319 . . . . 75.209999999999994 110.851 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.778 ' HA ' HG13 ' A' ' 121' ' ' VAL . 40.4 mtm180 -155.2 16.65 0.41 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 44.530000000000001 110.816 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.6 t -77.05 -69.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 61.409999999999997 111.165 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.718 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.35 -32.42 6.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 75.430000000000007 111.143 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.778 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -62.07 -43.33 97.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 71.219999999999999 111.152 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 6.0 t -61.75 -45.14 95.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 111.162 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.6 ptp180 -73.3 -38.29 65.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 61.219999999999999 110.835 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.99 -34.46 71.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 71.519999999999996 110.874 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 1.012 ' O ' HG12 ' A' ' 129' ' ' VAL . 10.8 p -71.54 -46.97 58.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.409999999999997 110.842 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.498 ' N ' ' SG ' ' A' ' 125' ' ' CYS . 1.7 t -56.36 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 63.009999999999998 110.892 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 123' ' ' ARG . 6.7 mt -75.86 -54.07 7.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.885 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.985 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.8 tt -54.67 -47.66 72.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 65.200000000000003 111.099 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 1.012 HG12 ' O ' ' A' ' 125' ' ' CYS . 14.1 p -74.06 -32.19 32.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 73.120000000000005 111.074 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.475 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 0.7 OUTLIER -53.26 -42.04 66.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 73.5 110.918 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.615 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 8.5 t80 -74.02 -55.88 5.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.149 -0.478 . . . . 72.109999999999999 110.882 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 8.0 mp -54.22 -55.05 31.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.471 . . . . 70.209999999999994 110.924 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.606 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 1.0 OUTLIER -48.71 -51.12 30.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 62.130000000000003 110.942 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -65.18 -28.03 69.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.072 -0.513 . . . . 65.409999999999997 110.937 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.624 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.16 -53.2 60.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 74.450000000000003 110.917 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.9 pt? -88.76 -24.04 22.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 55.030000000000001 110.939 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.606 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 27.9 mmt -82.16 23.14 0.75 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 64.409999999999997 110.962 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -88.27 162.1 31.93 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 53.420000000000002 112.453 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -53.14 -53.28 52.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.801 0.334 . . . . 75.329999999999998 110.886 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' NE ' ' HB3' ' A' ' 81' ' ' LYS . 1.8 ptt-85 -77.58 -46.97 20.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 72.120000000000005 110.855 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 10.9 m-70 -55.83 -61.18 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.227 -0.442 . . . . 75.140000000000001 110.901 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' ' CD ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -52.89 -47.94 67.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 62.200000000000003 110.869 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.91 -42.12 47.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 111.092 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -77.24 -48.33 17.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.259 -0.428 . . . . 72.329999999999998 110.917 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.852 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.01 -43.8 6.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 71.219999999999999 110.912 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.691 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -81.17 -38.95 26.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.867 179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.87 -14.61 1.02 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 111.116 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.659 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -109.85 25.05 12.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 64.019999999999996 110.929 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 96.98 -1.04 60.85 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.766 -0.731 . . . . 72.209999999999994 112.519 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 48.93 -174.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.813 -0.708 . . . . 70.319999999999993 112.473 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.532 ' CH2' ' CD1' ' A' ' 136' ' ' LEU . 75.3 m95 -38.13 -27.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.72 0.295 . . . . 72.140000000000001 110.86 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.4 OUTLIER -66.17 -47.37 74.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.191 -0.458 . . . . 62.420000000000002 110.87 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.38 -27.28 72.3 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.73 -0.748 . . . . 72.549999999999997 112.458 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.718 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.6 t80 -67.54 -57.94 5.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 65.430000000000007 110.883 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.688 ' HA ' HD23 ' A' ' 41' ' ' LEU . 16.7 p -51.58 -38.81 56.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.162 -0.472 . . . . 71.340000000000003 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.563 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.4 -26.84 41.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 71.25 110.895 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.43 ' CD2' ' CE1' ' A' ' 158' ' ' PHE . 2.2 t80 -69.86 -43.78 71.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 74.349999999999994 110.834 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.642 ' CD2' HG11 ' A' ' 45' ' ' VAL . 8.2 m-85 -97.02 8.08 45.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 73.450000000000003 110.891 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 158' ' ' PHE . 6.6 mmmm 34.68 80.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 55.310000000000002 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.68 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.96 168.03 0.19 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.576 0.703 . . . . 72.530000000000001 110.846 179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.459 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.5 Cg_endo -69.75 -44.21 2.22 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.659 2.239 . . . . 72.209999999999994 112.318 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.429 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 3.9 mm? -109.44 110.08 60.03 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.656 0.741 . . . . 63.420000000000002 110.878 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -50.64 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 61.340000000000003 112.364 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.2 mp -101.44 165.51 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.258 -0.428 . . . . 75.0 110.884 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.259 -1.136 . . . . 73.109999999999999 110.259 179.876 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.326 -1.11 . . . . 71.299999999999997 110.326 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.8 -90.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.614 2.209 . . . . 75.349999999999994 112.311 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.615 HD13 ' O ' ' A' ' -3' ' ' LEU . 0.7 OUTLIER 48.26 36.4 6.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 70.420000000000002 110.906 179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -143.5 161.1 27.71 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.767 -0.73 . . . . 54.210000000000001 112.497 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 29.1 t -108.88 74.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.845 0.355 . . . . 75.310000000000002 110.83 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ptp -91.01 -38.68 12.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 72.340000000000003 110.856 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.95 150.97 36.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.225 -0.443 . . . . 63.109999999999999 111.092 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.09 4.14 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 71.219999999999999 110.848 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.416 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 47.1 t -111.53 51.7 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.866 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -52.01 -40.54 61.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.430000000000007 110.959 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -110.33 143.14 27.47 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.55 0.691 . . . . 73.299999999999997 110.833 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.67 -9.08 25.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.667 2.245 . . . . 20.129999999999999 112.36 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.792 HD23 ' HE1' ' A' ' 137' ' ' MET . 0.7 OUTLIER -113.0 11.86 19.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.192 -0.458 . . . . 71.040000000000006 110.975 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.656 ' CG ' ' N ' ' A' ' 10' ' ' GLU . 1.9 p80 -69.6 -54.44 14.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.468 . . . . 72.129999999999995 110.813 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.656 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 3.1 pt-20 -82.25 -12.35 58.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.438 . . . . 73.349999999999994 110.939 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.696 ' NE ' HD12 ' A' ' 8' ' ' LEU . 14.9 mtm180 -75.07 -51.04 14.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 75.540000000000006 110.873 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.954 ' CG2' HD21 ' A' ' 136' ' ' LEU . 98.5 m -74.92 -40.1 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 72.299999999999997 111.132 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -60.86 -52.93 62.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.853 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.547 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.16 -45.02 96.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 64.530000000000001 110.908 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 38' ' ' GLU . 0.2 OUTLIER -61.76 -52.84 62.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.941 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.806 ' HB3' HG13 ' A' ' 129' ' ' VAL . 5.0 mp -58.71 -51.58 69.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 70.239999999999995 110.908 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.521 ' HA ' HG21 ' A' ' 129' ' ' VAL . 9.6 m -62.31 -39.52 93.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.236 -0.438 . . . . 64.329999999999998 110.845 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -55.58 -45.07 77.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.489 . . . . 73.450000000000003 110.853 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.732 ' CE1' HG21 ' A' ' 46' ' ' THR . 87.6 t80 -60.96 -40.52 93.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.42 . . . . 75.530000000000001 110.967 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.66 HG21 ' CB ' ' A' ' 125' ' ' CYS . 8.8 mm -51.34 -44.7 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 64.439999999999998 111.122 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -62.93 -52.08 64.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.862 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -55.95 -29.05 59.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 74.439999999999998 110.882 -179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.429 ' SG ' ' CZ ' ' A' ' 19' ' ' TYR . 1.3 m -87.79 -13.25 42.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 64.239999999999995 110.941 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.08 17.22 1.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.161 -0.472 . . . . 65.549999999999997 111.075 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -110.58 112.61 24.63 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.213 -0.449 . . . . 64.109999999999999 110.856 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -38.23 155.62 0.11 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.689 0.757 . . . . 73.129999999999995 110.798 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -12.99 34.17 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.687 2.258 . . . . 74.040000000000006 112.311 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -87.66 5.68 38.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.287 -0.415 . . . . 72.430000000000007 110.877 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -143.24 141.14 18.69 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.674 0.749 . . . . 72.239999999999995 111.109 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 136.91 34.13 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.632 2.222 . . . . 53.399999999999999 112.325 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.579 ' HB2' ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -79.89 156.83 74.62 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.668 0.747 . . . . 73.420000000000002 110.861 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 169.63 18.49 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.646 2.231 . . . . 74.349999999999994 112.334 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 159.07 54.76 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.703 2.269 . . . . 74.329999999999998 112.339 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 170.16 17.21 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.691 2.26 . . . . 72.019999999999996 112.377 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.436 HG21 ' HE ' ' A' ' 14' ' ' ARG . 1.5 m -97.25 -58.01 2.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 61.299999999999997 111.089 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.464 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -133.6 -177.41 4.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.436 . . . . 61.149999999999999 110.82 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.632 HG12 ' SG ' ' A' ' 155' ' ' CYS . 2.1 t -51.12 -56.31 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.083 -0.508 . . . . 73.030000000000001 111.198 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.776 ' HB2' HD22 ' A' ' 15' ' ' LEU . 5.2 pt-20 -52.34 -40.05 61.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.299999999999997 110.923 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.26 -33.91 67.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 65.140000000000001 111.068 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.55 -43.08 67.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.23 -0.441 . . . . 73.25 111.057 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.944 HD11 ' HB2' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -54.99 -53.31 57.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.263 -0.426 . . . . 63.409999999999997 110.937 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.835 HD21 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -52.16 -50.91 60.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 53.310000000000002 110.964 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -52.69 -26.08 12.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 62.140000000000001 110.947 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -90.31 -46.62 8.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 65.540000000000006 110.902 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.8 HG11 ' CD2' ' A' ' 158' ' ' PHE . 29.9 m -93.04 -53.7 8.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 111.142 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.732 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -49.51 -31.82 10.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 75.430000000000007 111.178 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -63.62 -30.46 71.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 71.329999999999998 110.839 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.642 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.29 -32.97 38.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 71.129999999999995 110.952 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.642 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.9 mm -63.9 -34.52 68.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 74.109999999999999 111.161 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.687 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.5 mt-30 -81.15 -62.42 1.67 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.5 110.949 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -46.08 -20.55 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.438 . . . . 74.019999999999996 110.927 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.54 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 6.9 pt-20 -97.75 -43.17 7.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.205 -0.452 . . . . 72.120000000000005 110.884 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.62 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 99.2 m-70 -100.86 -44.14 5.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 54.25 110.901 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.687 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -34.03 -29.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.884 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 53' ' ' HIS . 0.0 OUTLIER -48.38 -44.94 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 75.140000000000001 110.858 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -88.35 -41.36 12.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 60.439999999999998 110.855 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.62 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 16.1 m-30 -53.11 -62.03 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.239999999999995 110.9 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 t -55.22 -47.93 74.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.141 -0.481 . . . . 62.140000000000001 110.862 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 t -51.39 -34.63 35.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.126 -0.488 . . . . 52.039999999999999 110.9 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.581 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 1.0 OUTLIER -84.71 -40.96 16.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 73.219999999999999 110.887 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.9 OUTLIER -41.74 -45.4 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.824 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 4.7 pt-20 -84.1 33.44 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.913 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.442 ' C ' ' HD2' ' A' ' 64' ' ' ARG . 9.6 t -107.35 -67.76 0.93 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.239999999999995 110.893 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.598 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.0 OUTLIER -107.66 -6.32 16.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.085 -0.507 . . . . 70.150000000000006 110.915 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 72.81 5.27 64.14 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.694 -0.765 . . . . 71.450000000000003 112.471 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.826 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -80.72 32.23 0.3 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.363 . . . . 73.129999999999995 110.912 -179.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.856 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.5 OUTLIER -32.55 -34.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 75.510000000000005 110.889 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.986 HD12 HD13 ' A' ' 127' ' ' LEU . 3.2 tt -75.43 -49.92 17.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 75.450000000000003 110.913 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 66' ' ' ASN . 6.6 mm-40 -49.14 -32.82 10.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 75.040000000000006 110.893 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.826 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -80.66 -32.78 36.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 61.310000000000002 110.936 -179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.964 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.96 -48.65 85.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.155 -0.475 . . . . 64.150000000000006 111.123 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 131' ' ' PHE . 0.2 OUTLIER -73.73 -34.79 64.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.869 179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.52 ' N ' ' HG2' ' A' ' 72' ' ' LYS . 2.3 mp0 -62.5 -47.48 83.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.433 . . . . 74.120000000000005 110.969 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.772 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 10.2 mmm -57.47 -57.76 11.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 70.439999999999998 110.909 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -52.88 -20.05 3.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 62.43 111.14 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -81.57 -29.15 33.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 75.530000000000001 110.94 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.86 ' HG3' HD23 ' A' ' 78' ' ' LEU . 4.8 ptpt -86.52 -49.79 7.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.894 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.89 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -78.2 -59.38 2.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 65.310000000000002 110.911 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -86.63 154.86 20.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.456 . . . . 73.430000000000007 110.942 179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.595 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.1 OUTLIER -161.72 -173.68 3.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 75.019999999999996 110.831 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.48 ' CA ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -100.67 -41.84 6.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 72.239999999999995 110.834 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.412 ' CB ' HE22 ' A' ' 83' ' ' GLN . 0.3 OUTLIER -95.75 -8.68 33.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.436 . . . . 74.299999999999997 110.874 179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.605 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -91.0 127.85 36.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 72.519999999999996 110.934 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -64.05 74.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 72.310000000000002 110.863 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.819 ' CE2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -56.38 117.34 3.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 65.349999999999994 110.913 -179.84 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.2 t -83.05 162.11 21.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 64.409999999999997 110.908 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.711 ' NE1' HD13 ' A' ' 148' ' ' LEU . 4.2 m95 -55.79 -30.12 60.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.903 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.5 m -61.2 -36.95 81.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 110.883 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.499 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -73.11 -38.71 66.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.329999999999998 110.939 -179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.819 HD21 ' CE2' ' A' ' 85' ' ' PHE . 2.7 mm? -53.08 -56.0 19.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 65.349999999999994 110.982 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.685 ' CG1' ' CZ ' ' A' ' 154' ' ' PHE . 14.6 m -66.71 -32.47 58.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.134 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 92' ' ' MET . 2.3 tmm? -58.32 -44.73 88.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 64.219999999999999 110.819 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.837 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -63.18 -43.45 98.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.296 -0.411 . . . . 73.239999999999995 110.887 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.835 HD23 HD21 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.51 -45.09 85.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.21 -0.45 . . . . 42.140000000000001 110.864 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.697 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -60.28 -56.91 15.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 54.219999999999999 111.105 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.944 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.7 t80 -49.12 -60.03 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 70.310000000000002 110.896 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.976 ' HB2' ' CD1' ' A' ' 132' ' ' LEU . . . -38.34 -49.78 1.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 54.299999999999997 111.024 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.466 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -70.75 -26.04 74.71 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.725 -0.75 . . . . 61.130000000000003 112.485 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -72.73 -26.98 61.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.343 . . . . 73.340000000000003 111.11 -179.869 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.944 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.7 mt -79.62 -35.36 39.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 73.140000000000001 110.916 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.566 ' HE1' ' HB3' ' A' ' 124' ' ' ASP . 15.6 tpp -34.76 104.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 73.230000000000004 110.878 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -83.73 161.38 21.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.228 -0.442 . . . . 54.420000000000002 110.926 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -149.76 117.61 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 63.310000000000002 110.897 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.426 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -152.69 53.29 0.47 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.76 -0.734 . . . . 54.520000000000003 112.524 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.515 ' HB2' ' CD1' ' A' ' 106' ' ' TYR . 54.1 Cg_endo -69.73 -163.32 0.1 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.703 2.269 . . . . 74.109999999999999 112.341 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -54.73 -83.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 73.5 110.94 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.671 ' HE2' ' H ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -152.05 -156.56 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.109999999999999 110.93 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.498 ' N ' ' HG2' ' A' ' 107' ' ' MET . . . -142.35 104.59 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 71.310000000000002 111.073 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.643 HG13 ' N ' ' A' ' 110' ' ' LYS . 13.0 p -155.24 -52.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.175 -0.466 . . . . 75.219999999999999 111.119 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.643 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.2 OUTLIER -106.15 77.6 1.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 71.420000000000002 110.896 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -127.97 -60.43 1.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 74.209999999999994 110.88 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.41 ' NZ ' ' HB3' ' A' ' 112' ' ' LYS . 0.3 OUTLIER 38.11 51.03 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.183 -0.462 . . . . 65.129999999999995 110.927 -179.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 10.3 tpt85 72.9 37.44 0.81 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 71.420000000000002 110.914 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -133.49 -1.13 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 62.509999999999998 110.92 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.594 HD12 ' OD1' ' A' ' 117' ' ' ASN . 1.9 pt? -46.91 -48.51 21.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.828 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' N ' ' HG ' ' A' ' 115' ' ' LEU . . . 37.22 30.97 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.792 -0.718 . . . . 53.43 112.474 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.594 ' OD1' HD12 ' A' ' 115' ' ' LEU . 1.4 p-10 -47.5 136.28 10.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 74.239999999999995 110.847 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.777 ' HA ' HG13 ' A' ' 121' ' ' VAL . 32.0 ptt180 -158.32 19.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.465 . . . . 74.239999999999995 110.919 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -68.91 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 74.340000000000003 111.133 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.724 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.01 -34.03 7.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.187 -0.461 . . . . 71.319999999999993 111.163 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.777 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -60.62 -42.32 91.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.122 -0.49 . . . . 62.229999999999997 111.124 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.512 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -64.12 -41.91 97.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.175 -0.466 . . . . 73.400000000000006 111.171 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.425 ' N ' HG23 ' A' ' 122' ' ' THR . 2.2 ptt180 -75.42 -34.21 60.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 72.010000000000005 110.876 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.566 ' HB3' ' HE1' ' A' ' 101' ' ' MET . 4.8 t0 -77.51 -32.71 54.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.242 -0.435 . . . . 64.030000000000001 110.818 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.66 ' CB ' HG21 ' A' ' 20' ' ' ILE . 14.4 p -69.85 -37.69 76.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 51.329999999999998 110.933 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 45.3 t -65.77 -54.31 28.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 55.420000000000002 110.882 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.986 HD13 HD12 ' A' ' 68' ' ' LEU . 2.8 pp -64.17 -54.45 33.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.935 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.964 ' CG1' HG21 ' A' ' 71' ' ' VAL . 6.6 tt -53.48 -49.01 57.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.329999999999998 111.153 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.806 HG13 ' HB3' ' A' ' 16' ' ' LEU . 90.0 t -69.74 -31.28 47.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.126 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.404 ' O ' ' OD1' ' A' ' 134' ' ' ASN . 20.9 t-20 -48.8 -49.33 39.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 74.510000000000005 110.917 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.643 ' CZ ' ' HB2' ' A' ' 72' ' ' LYS . 4.8 t80 -68.21 -54.4 18.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.105 -0.498 . . . . 75.329999999999998 110.857 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.976 ' CD1' ' HB2' ' A' ' 97' ' ' ALA . 2.3 mt -58.22 -26.06 62.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 75.409999999999997 110.909 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.519 ' O ' ' CB ' ' A' ' 137' ' ' MET . 0.8 OUTLIER -72.91 -50.43 23.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 75.209999999999994 110.923 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.592 HD22 ' N ' ' A' ' 135' ' ' LEU . 0.5 OUTLIER -71.84 -31.75 66.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 75.129999999999995 110.854 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.818 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.77 -48.72 78.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 65.230000000000004 110.899 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.954 HD21 ' CG2' ' A' ' 12' ' ' THR . 0.9 OUTLIER -89.87 -22.92 21.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 74.200000000000003 110.888 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.792 ' HE1' HD23 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -91.27 24.72 2.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.844 179.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.35 170.22 50.42 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 72.439999999999998 112.561 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -57.49 -54.19 49.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.83 0.348 . . . . 75.25 110.926 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.48 ' HG3' ' CA ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -79.04 -40.12 32.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 61.439999999999998 110.817 -179.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.595 ' CD2' ' O ' ' A' ' 80' ' ' SER . 11.6 m80 -60.51 -57.75 11.39 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 110.923 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.585 ' HE ' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -61.42 -47.78 84.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 64.430000000000007 110.922 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.86 -44.63 49.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 34.530000000000001 111.143 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.9 mmt85 -76.85 -46.9 23.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 110.841 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.828 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.41 -45.14 6.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 75.409999999999997 110.858 -179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.703 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -81.2 -33.76 32.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 73.430000000000007 110.871 179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -58.1 -14.66 7.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 62.229999999999997 111.095 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.711 HD13 ' NE1' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.31 23.74 13.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 71.219999999999999 110.908 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 99.62 -3.22 57.55 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 112.536 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 51.87 -174.23 0.18 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.713 -0.756 . . . . 54.43 112.511 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 47.7 m95 -38.13 -26.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.346 . . . . 75.329999999999998 110.935 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.3 OUTLIER -70.18 -47.48 61.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.873 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.25 -29.53 75.53 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.718 -0.753 . . . . 65.310000000000002 112.52 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.685 ' CZ ' ' CG1' ' A' ' 91' ' ' VAL . 2.3 t80 -67.7 -56.25 10.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.343 . . . . 61.329999999999998 110.875 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.632 ' SG ' HG12 ' A' ' 37' ' ' VAL . 28.3 m -51.7 -36.79 48.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.106 -0.497 . . . . 71.200000000000003 110.874 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.569 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.24 -26.81 42.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 74.329999999999998 110.846 -179.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.75 ' CE2' ' CE1' ' A' ' 158' ' ' PHE . 0.5 OUTLIER -69.83 -44.22 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 75.420000000000002 110.932 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.944 ' HB2' HD11 ' A' ' 41' ' ' LEU . 47.0 m-85 -92.61 0.11 57.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 74.349999999999994 110.874 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? 48.43 80.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.465 . . . . 74.329999999999998 110.871 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.496 ' OD1' ' N ' ' A' ' 162' ' ' LEU . 0.2 OUTLIER -48.86 151.23 2.25 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.549 0.69 . . . . 62.409999999999997 110.899 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.447 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 53.2 Cg_endo -69.75 -49.34 0.57 Allowed 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 122.707 2.271 . . . . 62.240000000000002 112.352 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.496 ' N ' ' OD1' ' A' ' 160' ' ' ASN . 0.5 OUTLIER -58.73 161.87 7.68 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.604 0.716 . . . . 70.430000000000007 110.916 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.82 -90.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.717 2.278 . . . . 60.549999999999997 112.319 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 3.9 mp -100.74 -175.13 2.81 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.246 -0.434 . . . . 54.420000000000002 110.891 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.493 ' C ' HG22 ' A' ' 37' ' ' VAL . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 110.25 -1.14 . . . . 33.039999999999999 110.25 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.273 -1.131 . . . . 25.199999999999999 110.273 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -48.72 0.66 Allowed 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.739 2.293 . . . . 73.219999999999999 112.335 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . 0.732 ' O ' HD12 ' A' ' -3' ' ' LEU . 4.7 tp -68.39 -24.24 64.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 73.549999999999997 110.939 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -79.0 -72.4 1.19 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 52.32 112.458 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 3.9 m -99.37 75.24 1.97 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.822 0.344 . . . . 70.010000000000005 110.888 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -44.48 62.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.209999999999994 110.889 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.65 175.6 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 63.240000000000002 111.133 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.1 -26.24 12.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 70.109999999999999 110.854 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 t -74.65 -19.28 60.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 52.340000000000003 110.857 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -84.8 32.19 0.53 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 75.329999999999998 110.937 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.693 ' CB ' ' CD2' ' A' ' 9' ' ' HIS . 29.9 m-20 -97.23 146.5 31.46 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.575 0.703 . . . . 74.0 110.838 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 -91.01 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.7 2.267 . . . . 54.200000000000003 112.279 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.796 HD12 ' CD1' ' A' ' 151' ' ' TRP . 0.3 OUTLIER -111.59 22.12 15.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 72.510000000000005 110.945 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.693 ' CD2' ' CB ' ' A' ' 6' ' ' ASP . 0.2 OUTLIER -62.33 -43.8 97.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.150000000000006 110.844 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.613 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 13.4 tt0 -67.38 -36.96 82.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.299999999999997 110.812 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 34.3 ttm180 -71.76 -32.43 67.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.21 -0.45 . . . . 72.239999999999995 110.882 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.785 HG21 HD11 ' A' ' 136' ' ' LEU . 2.8 m -79.62 -54.23 6.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 70.510000000000005 111.161 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 1.0 OUTLIER -47.71 -52.73 17.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 54.509999999999998 110.909 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.785 ' CZ ' HG21 ' A' ' 35' ' ' THR . 0.0 OUTLIER -65.53 -38.08 88.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 75.030000000000001 110.837 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -59.62 -42.97 93.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.409999999999997 110.866 -179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.97 ' HB3' HG13 ' A' ' 129' ' ' VAL . 1.0 OUTLIER -58.58 -53.8 54.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.22 -0.445 . . . . 64.540000000000006 110.89 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -29.91 70.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.271 -0.422 . . . . 64.329999999999998 110.852 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.563 ' OD2' ' HB1' ' A' ' 39' ' ' ALA . 37.5 t70 -55.9 -52.5 63.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 70.400000000000006 110.954 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.691 ' CZ ' HD12 ' A' ' 20' ' ' ILE . 1.7 p90 -69.01 -22.87 64.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.132 -0.486 . . . . 73.340000000000003 110.929 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.695 HD13 HG22 ' A' ' 129' ' ' VAL . 0.3 OUTLIER -79.74 -33.55 15.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 64.530000000000001 111.203 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -66.01 -43.17 88.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 74.519999999999996 110.888 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' CE2' ' CG ' ' A' ' 31' ' ' GLU . 0.1 OUTLIER -68.73 -37.53 79.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 62.530000000000001 110.944 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.421 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -62.68 -27.97 69.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.484 . . . . 71.129999999999995 110.879 -179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.979 ' HB1' ' CD ' ' A' ' 103' ' ' GLN . . . -81.99 17.19 1.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 72.129999999999995 111.088 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -105.04 112.4 25.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.196 -0.456 . . . . 71.019999999999996 110.884 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -46.66 150.83 1.15 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.688 0.756 . . . . 71.329999999999998 110.859 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -20.29 35.43 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.669 2.246 . . . . 71.5 112.399 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -76.04 5.63 6.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.207 -0.451 . . . . 73.310000000000002 110.895 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.4 t -142.94 140.89 18.61 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.621 0.724 . . . . 73.219999999999999 111.148 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.75 135.4 30.38 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.644 2.229 . . . . 72.409999999999997 112.325 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.586 ' CG ' ' CE2' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -87.12 148.76 45.82 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.65 0.738 . . . . 75.019999999999996 110.88 -179.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 166.82 26.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.675 2.25 . . . . 72.109999999999999 112.369 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 170.8 15.72 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.65 2.233 . . . . 64.129999999999995 112.325 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 172.67 12.17 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.673 2.248 . . . . 74.129999999999995 112.336 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.785 HG21 ' CZ ' ' A' ' 14' ' ' ARG . 1.4 m -111.64 -58.26 2.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 64.450000000000003 111.117 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.472 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 3.9 m -115.15 172.28 7.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 71.310000000000002 110.811 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.447 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.8 t -57.44 -52.22 59.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.091 -0.504 . . . . 75.040000000000006 111.156 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.8 pm0 -64.8 -27.58 68.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.835 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.563 ' HB1' ' OD2' ' A' ' 18' ' ' ASP . . . -72.0 -37.92 69.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.21 -0.45 . . . . 62.039999999999999 111.072 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.13 -39.35 75.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 111.067 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.62 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.0 OUTLIER -56.25 -55.63 30.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 70.239999999999995 110.884 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.99 ' HG ' HD23 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -52.44 -44.09 65.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.246 -0.434 . . . . 61.200000000000003 110.876 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.0 -27.43 52.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 63.299999999999997 110.902 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -91.42 -42.93 10.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 65.019999999999996 110.862 -179.801 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.746 HG11 ' CD2' ' A' ' 158' ' ' PHE . 34.8 m -92.45 -54.74 6.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.125 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.671 ' N ' HG23 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -50.19 -31.56 14.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 111.139 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -66.35 -32.82 74.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 72.319999999999993 110.908 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.646 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -76.99 -33.73 57.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 63.140000000000001 110.894 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.646 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.3 mm -65.03 -32.21 57.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 111.144 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.712 ' O ' ' N ' ' A' ' 54' ' ' GLN . 8.5 mt-30 -80.65 -60.46 2.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 61.140000000000001 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -49.98 -19.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 75.319999999999993 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.577 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 7.9 pt-20 -96.38 -40.92 8.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.182 -0.463 . . . . 61.049999999999997 110.928 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.604 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.3 m-70 -104.09 -44.6 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.712 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.28 -23.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 71.140000000000001 110.92 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.5 mt-10 -46.49 -32.21 3.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.239999999999995 110.925 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -102.46 -40.73 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 64.299999999999997 110.882 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.604 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 7.9 m-85 -53.08 -52.67 57.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 63.140000000000001 110.901 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 t -50.01 -46.65 52.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.450000000000003 110.877 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 m -51.97 -36.99 51.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 72.239999999999995 110.794 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -77.72 -41.11 38.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 73.140000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.406 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -51.72 -21.35 2.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 110.821 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.3 mt-10 -122.26 29.97 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 110.858 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 m -118.4 -68.51 0.91 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 72.0 110.834 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.414 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 14.1 mmm180 -97.62 -14.87 20.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.888 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.428 ' HA2' ' NH1' ' A' ' 67' ' ' ARG . . . 73.05 9.45 76.25 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.779 -0.724 . . . . 51.340000000000003 112.494 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -84.12 30.55 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.79 0.329 . . . . 73.530000000000001 110.895 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.77 ' O ' HD13 ' A' ' 100' ' ' LEU . 14.3 mtm-85 -32.84 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 73.230000000000004 110.922 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.9 tp -79.17 -51.03 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.481 . . . . 71.540000000000006 110.943 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 3.9 mm-40 -51.38 -32.05 24.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.908 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.674 HD23 ' N ' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -78.83 -36.58 42.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.137 -0.483 . . . . 73.040000000000006 110.964 179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.95 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -60.9 -45.28 98.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.475 . . . . 63.509999999999998 111.158 179.831 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.694 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 2.7 ptpt -72.43 -44.02 62.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 71.299999999999997 110.882 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.6 mp0 -55.17 -49.56 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.439 . . . . 74.219999999999999 110.837 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.782 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 28.5 mmm -57.73 -55.45 34.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 63.210000000000001 110.849 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.784 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -50.95 -22.1 2.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 61.310000000000002 111.124 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -83.44 -29.07 28.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 70.049999999999997 110.895 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.923 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.1 ptpt -81.69 -48.81 11.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 71.129999999999995 110.907 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.923 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -80.72 -58.0 3.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 73.439999999999998 110.907 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.897 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -90.32 154.14 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 64.530000000000001 110.942 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.402 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -165.53 -171.68 2.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.837 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.471 ' CA ' ' HD2' ' A' ' 140' ' ' ARG . 0.2 OUTLIER -100.88 -44.28 5.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.143 -0.48 . . . . 61.020000000000003 110.938 179.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -10.26 33.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 64.430000000000007 110.866 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.617 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.21 127.77 35.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 72.019999999999996 110.871 -179.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.86 73.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 70.230000000000004 110.869 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 85' ' ' PHE . 0.1 OUTLIER -59.1 123.21 15.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 73.140000000000001 110.868 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t -96.23 159.09 15.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 61.210000000000001 110.805 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.965 ' CZ3' HD23 ' A' ' 90' ' ' LEU . 8.5 m95 -48.96 -36.65 17.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.021 -0.536 . . . . 75.140000000000001 110.97 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 92' ' ' MET . 0.7 OUTLIER -56.49 -37.62 70.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.243 -0.435 . . . . 64.540000000000006 110.834 -179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.528 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 8.3 mm100 -69.44 -45.22 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 70.430000000000007 110.943 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.965 HD23 ' CZ3' ' A' ' 87' ' ' TRP . 0.1 OUTLIER -48.81 -55.5 11.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 75.140000000000001 110.885 -179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.704 HG12 HD11 ' A' ' 42' ' ' LEU . 29.9 m -67.52 -30.59 49.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 53.049999999999997 111.137 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.589 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.2 tmm? -60.32 -45.73 92.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.909 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -64.54 -35.59 81.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 110.87 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.99 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -63.06 -42.14 99.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.902 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB1' ' HG3' ' A' ' 50' ' ' GLN . . . -64.94 -58.41 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 61.439999999999998 111.104 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.924 ' CE2' HD11 ' A' ' 100' ' ' LEU . 74.9 t80 -46.16 -59.35 2.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.91 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -41.08 -61.78 0.94 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 61.039999999999999 111.066 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.421 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -50.79 -32.01 24.85 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 71.340000000000003 112.541 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -70.23 -22.83 62.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 75.030000000000001 111.127 -179.849 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.924 HD11 ' CE2' ' A' ' 96' ' ' PHE . 3.3 mt -85.56 -39.54 17.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 55.119999999999997 110.91 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.565 ' CG ' ' HB2' ' A' ' 24' ' ' ALA . 20.4 tpp -31.73 106.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 110.889 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.538 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -71.45 151.06 44.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 65.230000000000004 110.819 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.979 ' CD ' ' HB1' ' A' ' 24' ' ' ALA . 39.2 mm-40 -146.51 122.37 10.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 72.549999999999997 110.882 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.627 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.21 40.68 0.93 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.728 -0.748 . . . . 44.350000000000001 112.483 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.9 Cg_endo -69.67 -162.9 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.71 2.273 . . . . 74.430000000000007 112.339 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.589 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.7 t80 -116.59 -10.03 11.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 75.540000000000006 110.923 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.482 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 20.5 mmt -36.0 95.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.063 -0.517 . . . . 73.030000000000001 110.921 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.571 ' C ' ' NE2' ' A' ' 111' ' ' GLN . . . -87.2 -106.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 72.319999999999993 111.154 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.787 ' N ' HE21 ' A' ' 111' ' ' GLN . 0.6 OUTLIER -121.01 -55.28 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 63.520000000000003 111.184 179.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.489 ' H ' HG13 ' A' ' 109' ' ' VAL . 1.8 mppt? -108.31 78.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 73.040000000000006 110.919 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.787 HE21 ' N ' ' A' ' 109' ' ' VAL . 3.2 mp0 -107.08 178.38 4.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.409 . . . . 73.109999999999999 110.967 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -78.97 -171.7 2.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.218 -0.447 . . . . 73.209999999999994 110.905 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -141.57 40.41 1.72 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 74.25 110.935 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -135.04 1.22 2.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 64.209999999999994 110.847 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.638 ' H ' HD12 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -97.66 -53.1 3.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 70.5 110.949 -179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 117' ' ' ASN . . . 57.18 103.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.779 -0.724 . . . . 72.129999999999995 112.447 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.504 ' ND2' HE22 ' A' ' 103' ' ' GLN . 62.5 t30 -37.86 111.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.868 0.366 . . . . 62.43 110.869 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.785 ' HA ' HG13 ' A' ' 121' ' ' VAL . 16.9 mtm180 -153.87 14.36 0.47 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 72.340000000000003 110.921 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 72.4 t -78.04 -68.69 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 74.340000000000003 111.149 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.721 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.32 -32.02 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 71.230000000000004 111.07 179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.785 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -63.01 -43.06 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 62.420000000000002 111.09 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.5 t -63.61 -42.95 98.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 74.150000000000006 111.167 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.454 ' N ' HG23 ' A' ' 122' ' ' THR . 3.5 ptm180 -74.58 -38.99 62.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.191 -0.458 . . . . 75.099999999999994 110.862 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.49 ' OD2' ' ND2' ' A' ' 102' ' ' ASN . 3.9 m-20 -71.78 -34.7 69.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 71.329999999999998 110.897 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.682 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.0 p -71.27 -40.62 70.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.873 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.41 -38.96 89.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.149 -0.478 . . . . 75.0 110.863 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.0 mt -75.83 -54.66 6.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.454 . . . . 55.439999999999998 110.913 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.95 ' CG1' HG21 ' A' ' 71' ' ' VAL . 3.5 tt -60.87 -47.52 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 73.25 111.122 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.97 HG13 ' HB3' ' A' ' 16' ' ' LEU . 60.7 t -66.69 -32.31 57.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 62.140000000000001 111.174 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.582 HD22 ' N ' ' A' ' 131' ' ' PHE . 0.1 OUTLIER -59.25 -52.35 66.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.519999999999996 110.888 179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.694 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.7 t80 -58.51 -56.11 26.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.896 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.955 HD21 ' HB2' ' A' ' 97' ' ' ALA . 6.2 mp -57.78 -54.95 41.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 75.530000000000001 110.935 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 137' ' ' MET . 2.5 t80 -44.8 -54.55 6.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -68.11 -27.65 66.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 63.219999999999999 110.885 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.784 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -56.58 -50.25 72.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.192 -0.458 . . . . 74.239999999999995 110.884 179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.962 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -95.87 -19.06 19.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.912 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.959 ' N ' HD13 ' A' ' 136' ' ' LEU . 8.0 tpp -86.1 24.4 1.33 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 65.319999999999993 110.91 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -82.68 161.81 40.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 71.310000000000002 112.496 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -51.83 -54.4 29.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.888 0.375 . . . . 52.420000000000002 110.945 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.471 ' HD2' ' CA ' ' A' ' 81' ' ' LYS . 0.8 OUTLIER -78.89 -44.05 23.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 71.219999999999999 110.871 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.43 ' N ' ' CG ' ' A' ' 140' ' ' ARG . 40.1 m-70 -55.95 -61.4 2.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 64.549999999999997 110.829 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.464 ' C ' ' HD3' ' A' ' 142' ' ' ARG . 2.1 tmt_? -54.15 -46.03 72.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.499 . . . . 70.140000000000001 110.849 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.45 -43.12 44.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 72.219999999999999 111.099 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.6 -46.78 24.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.519999999999996 110.917 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -44.21 -45.31 8.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 63.140000000000001 110.923 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.72 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.01 -30.99 34.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 53.299999999999997 110.895 179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.87 -13.96 29.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 73.5 111.126 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.687 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.59 19.75 18.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 74.409999999999997 110.926 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 104.71 -2.64 42.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 72.540000000000006 112.521 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.496 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 50.0 -176.44 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 71.030000000000001 112.495 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.796 ' CD1' HD12 ' A' ' 8' ' ' LEU . 58.2 m95 -39.28 -25.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 73.439999999999998 110.923 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 150' ' ' GLY . 0.8 OUTLIER -67.64 -47.56 69.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.215 -0.448 . . . . 53.439999999999998 110.865 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.22 -30.12 76.54 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.692 -0.766 . . . . 74.420000000000002 112.537 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.702 ' CE1' HG11 ' A' ' 91' ' ' VAL . 3.7 t80 -67.96 -60.1 2.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.801 0.334 . . . . 74.299999999999997 110.913 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.528 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 t -51.31 -40.95 60.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.132 -0.486 . . . . 73.140000000000001 110.893 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.55 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -78.99 -24.73 43.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 110.896 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.548 ' N ' ' HD2' ' A' ' 156' ' ' ARG . 0.6 OUTLIER -74.39 -42.42 59.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 62.240000000000002 110.89 -179.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.746 ' CD2' HG11 ' A' ' 45' ' ' VAL . 28.4 m-85 -87.52 -3.78 58.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.116 -0.493 . . . . 72.430000000000007 110.929 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp 50.63 74.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 73.329999999999998 110.906 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.585 ' CB ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -48.65 165.88 0.24 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.667 0.746 . . . . 61.100000000000001 110.846 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 160' ' ' ASN . 53.7 Cg_endo -69.84 -50.63 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.681 2.254 . . . . 74.430000000000007 112.322 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -99.15 112.77 63.85 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.553 0.692 . . . . 60.310000000000002 110.902 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 -49.86 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.652 2.235 . . . . 74.010000000000005 112.363 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.93 176.96 3.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.213 -0.448 . . . . 64.439999999999998 110.935 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.322 -1.111 . . . . 64.099999999999994 110.322 179.913 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.517 0 N-CA-C 110.264 -1.134 . . . . 73.230000000000004 110.264 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -90.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.654 2.236 . . . . 74.439999999999998 112.377 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 6.8 tp 56.65 39.6 29.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.917 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 58.25 -167.01 6.35 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.742 -0.742 . . . . 44.119999999999997 112.476 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.1 m -87.04 165.53 15.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 63.039999999999999 110.855 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 ptp -91.06 -54.04 4.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 71.319999999999993 110.893 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 177.96 5.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 64.439999999999998 111.11 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -122.39 -76.67 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 72.109999999999999 110.807 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 m -64.11 -24.07 67.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 64.120000000000005 110.839 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -100.74 53.02 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 64.0 110.953 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 5.9 m-20 -52.73 107.64 0.89 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.542 0.687 . . . . 63.329999999999998 110.868 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 6' ' ' ASP . 53.8 Cg_endo -69.8 4.83 1.98 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.644 2.23 . . . . 72.299999999999997 112.344 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' CD2' ' CD1' ' A' ' 151' ' ' TRP . 0.1 OUTLIER -64.67 -26.04 68.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.213 -0.449 . . . . 74.439999999999998 110.912 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -48.07 -81.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 74.439999999999998 110.85 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.454 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 9.2 tp10 -59.67 -13.15 8.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.197 -0.456 . . . . 71.299999999999997 110.84 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -70.12 -41.44 73.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 110.865 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.966 HG21 HD11 ' A' ' 136' ' ' LEU . 53.8 m -75.66 -47.36 26.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 111.169 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HD3' ' CD2' ' A' ' 133' ' ' TYR . 8.0 tpp180 -56.13 -51.13 69.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 71.430000000000007 110.883 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.619 ' HD3' HG21 ' A' ' 35' ' ' THR . 0.0 OUTLIER -61.57 -46.27 90.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 71.409999999999997 110.919 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.738 HD22 ' CG ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -58.54 -52.18 66.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 71.430000000000007 110.861 -179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.749 HD11 HD11 ' A' ' 94' ' ' LEU . 3.5 mp -60.08 -52.0 67.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.24 -0.437 . . . . 54.109999999999999 110.914 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.6 t -61.68 -34.98 76.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 64.510000000000005 110.897 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.432 ' OD2' ' CB ' ' A' ' 35' ' ' THR . 13.1 m-20 -59.42 -34.64 72.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 52.25 110.887 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.666 ' CE1' HG21 ' A' ' 46' ' ' THR . 89.4 t80 -74.99 -30.21 61.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 61.030000000000001 110.883 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.947 HG23 ' HG3' ' A' ' 101' ' ' MET . 21.0 mm -62.04 -47.61 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 72.040000000000006 111.194 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.09 -48.99 71.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 72.219999999999999 110.907 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -56.05 -28.89 59.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 73.310000000000002 110.862 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.04 -14.34 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.138 -0.483 . . . . 63.219999999999999 110.833 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.54 17.02 1.89 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 53.130000000000003 111.066 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -119.58 113.14 20.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 64.329999999999998 110.831 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -38.79 154.5 0.15 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.638 0.732 . . . . 54.100000000000001 110.91 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -13.1 34.33 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.68 2.254 . . . . 72.030000000000001 112.413 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -86.83 5.8 34.85 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.45 . . . . 75.239999999999995 110.88 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 t -138.32 141.17 30.74 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.646 0.736 . . . . 62.149999999999999 111.105 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 137.54 35.66 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.584 2.189 . . . . 52.140000000000001 112.355 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HG2' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -96.11 162.84 22.49 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 121.714 0.768 . . . . 74.540000000000006 110.852 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.75 23.52 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.661 2.24 . . . . 73.239999999999995 112.327 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 170.22 17.24 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.595 2.197 . . . . 72.239999999999995 112.337 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 165.71 29.98 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.715 2.277 . . . . 75.010000000000005 112.368 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.619 HG21 ' HD3' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -94.71 -31.69 13.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 73.120000000000005 111.106 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.601 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 8.4 m -161.02 -176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.261 -0.427 . . . . 51.310000000000002 110.861 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.872 HG13 HD11 ' A' ' 162' ' ' LEU . 1.9 t -55.64 -47.5 78.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 73.0 111.093 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.738 ' CG ' HD22 ' A' ' 15' ' ' LEU . 22.1 pt-20 -62.53 -32.27 73.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 74.129999999999995 110.913 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.601 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.24 -33.59 69.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 74.310000000000002 111.143 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.659 ' HB3' HD21 ' A' ' 160' ' ' ASN . . . -71.19 -40.3 71.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.444 . . . . 64.519999999999996 111.084 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.752 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -56.37 -56.04 26.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 110.954 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.913 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -52.17 -47.71 65.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.945 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -53.26 -27.12 20.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.479 . . . . 61.520000000000003 110.903 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.4 OUTLIER -91.29 -44.76 9.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 54.219999999999999 110.84 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.785 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.1 m -91.16 -54.9 6.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 111.071 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.716 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -50.07 -36.64 30.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 74.209999999999994 111.174 179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.528 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.95 -33.1 71.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.901 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.589 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -78.26 -33.26 49.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.13 -0.486 . . . . 73.129999999999995 110.891 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.589 HD13 ' HG3' ' A' ' 48' ' ' GLN . 10.5 mm -62.53 -34.68 66.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.234 -0.439 . . . . 75.439999999999998 111.109 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.682 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.1 mt-30 -81.74 -62.55 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 60.539999999999999 110.924 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -45.08 -20.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 73.120000000000005 110.888 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' A' ' 53' ' ' HIS . 8.3 pt-20 -97.41 -42.97 7.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.233 -0.44 . . . . 63.149999999999999 110.905 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 88.0 m-70 -101.99 -43.57 5.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 71.510000000000005 110.917 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.682 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -31.46 -31.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 110.961 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.6 ' N ' ' O ' ' A' ' 53' ' ' HIS . 2.4 mt-10 -48.79 -47.41 42.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.206 -0.452 . . . . 75.329999999999998 110.865 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -86.12 -42.2 14.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 70.030000000000001 110.885 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 17.3 m-30 -52.94 -62.03 1.91 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.9 p -61.01 -41.43 96.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.849 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 m -51.2 -39.42 56.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 71.430000000000007 110.854 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.578 ' HE1' HD21 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -84.74 -45.15 12.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 74.5 110.864 -179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.47 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 1.4 p -41.4 -43.77 2.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 41.299999999999997 110.907 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.47 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 12.6 pt-20 -84.31 33.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 55.439999999999998 110.912 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 60' ' ' PHE . 38.7 t -110.29 -58.6 2.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 61.310000000000002 110.863 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 64' ' ' ARG . 0.1 OUTLIER -104.81 -35.56 7.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 75.129999999999995 110.926 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.67 2.1 46.55 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.647 -0.787 . . . . 64.209999999999994 112.489 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.723 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -81.65 32.33 0.36 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.747 0.308 . . . . 73.430000000000007 110.877 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.642 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.0 mtt85 -31.95 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 62.299999999999997 110.87 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.691 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -72.16 -51.11 22.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 110.941 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' A' ' 66' ' ' ASN . 1.2 pt-20 -55.14 -30.75 60.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 64.510000000000005 110.824 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.723 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.8 OUTLIER -75.26 -31.97 60.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.128 -0.487 . . . . 72.420000000000002 110.964 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.782 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -65.6 -45.4 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 71.450000000000003 111.152 179.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.682 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 0.0 OUTLIER -71.75 -40.67 69.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.183 -0.462 . . . . 73.219999999999999 110.908 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.487 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.3 mp0 -54.63 -48.3 72.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.201 -0.454 . . . . 72.239999999999995 110.926 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.744 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 15.7 mmm -57.39 -55.31 36.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.826 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.554 ' CB ' ' CD1' ' A' ' 135' ' ' LEU . . . -51.23 -22.44 2.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 64.109999999999999 111.098 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -31.21 42.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 110.961 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.893 ' HG2' HD23 ' A' ' 78' ' ' LEU . 12.2 ptpt -81.63 -47.86 12.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 65.230000000000004 110.941 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.893 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.04 -63.13 1.45 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.958 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -81.27 155.64 25.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.935 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.469 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -161.88 -170.59 2.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.465 . . . . 70.099999999999994 110.877 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -101.15 -48.1 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.888 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 0.2 OUTLIER -95.09 12.4 28.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 70.030000000000001 110.897 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.583 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -103.43 138.1 40.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.938 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -74.74 59.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 64.040000000000006 110.859 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.815 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -44.81 128.74 7.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 73.439999999999998 110.849 -179.875 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 29.3 t -99.55 163.57 12.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.144 -0.48 . . . . 63.020000000000003 110.827 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 1.034 ' CE3' HD12 ' A' ' 90' ' ' LEU . 11.3 m95 -53.44 -30.58 41.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 110.927 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.3 t -62.61 -31.95 72.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.208 -0.451 . . . . 70.549999999999997 110.83 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.549 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.5 mm100 -74.98 -39.74 61.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 73.319999999999993 110.87 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.034 HD12 ' CE3' ' A' ' 87' ' ' TRP . 8.6 mt -58.18 -55.43 35.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.199 -0.455 . . . . 64.140000000000001 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.725 HG11 ' CE1' ' A' ' 154' ' ' PHE . 26.2 m -61.84 -31.59 51.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.109999999999999 111.14 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.453 ' HB3' ' HE3' ' A' ' 92' ' ' MET . 2.2 tmm? -59.23 -45.47 91.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 74.219999999999999 110.919 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.842 HD11 ' HG ' ' A' ' 79' ' ' LEU . 1.6 mt -59.05 -48.22 82.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 63.420000000000002 110.91 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.913 HD23 ' HG ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -52.94 -45.8 67.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 51.109999999999999 110.918 179.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.716 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -63.28 -57.76 9.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.471 . . . . 52.109999999999999 111.156 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.898 ' CE2' HD21 ' A' ' 100' ' ' LEU . 60.3 t80 -47.33 -59.75 2.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.898 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -39.41 -58.96 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 54.049999999999997 111.119 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.431 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -59.72 -24.3 59.78 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.749 -0.739 . . . . 71.120000000000005 112.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.71 -23.42 59.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 70.109999999999999 111.174 -179.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.995 HD12 HD11 ' A' ' 128' ' ' ILE . 1.1 mt -88.3 -56.94 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 72.329999999999998 110.948 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.947 ' HG3' HG23 ' A' ' 20' ' ' ILE . 35.4 mmm -31.13 108.9 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 44.329999999999998 110.882 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.539 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -92.43 159.2 15.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 72.319999999999993 110.911 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 102' ' ' ASN . 2.4 mm100 -137.84 118.39 13.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 72.409999999999997 110.959 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.58 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -150.93 43.95 0.69 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.795 -0.716 . . . . 60.409999999999997 112.489 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.58 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.76 -162.73 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.623 2.215 . . . . 71.230000000000004 112.381 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.515 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 6.4 t80 -86.94 -16.79 34.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.454 . . . . 64.200000000000003 110.86 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.554 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 16.1 mmt -36.75 93.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 32.130000000000003 110.828 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -106.68 -153.1 0.49 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 70.230000000000004 111.109 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.828 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -64.28 -84.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.010000000000005 111.133 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.828 ' N ' HG22 ' A' ' 109' ' ' VAL . 8.8 mttt -71.55 95.2 1.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 74.239999999999995 110.818 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.426 ' NE2' ' HB3' ' A' ' 108' ' ' ALA . 26.3 mm-40 -141.16 -163.32 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 72.230000000000004 110.914 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.423 ' HG3' ' N ' ' A' ' 113' ' ' ARG . 3.2 tppp? -169.95 149.1 3.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 64.099999999999994 110.892 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.423 ' N ' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -71.26 84.98 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 72.099999999999994 110.893 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -115.51 -53.25 2.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 43.149999999999999 110.842 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.3 OUTLIER -102.51 -20.6 14.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 75.219999999999999 110.953 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.694 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 56.75 114.01 0.01 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.705 -0.76 . . . . 54.329999999999998 112.472 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.452 ' C ' ' O ' ' A' ' 116' ' ' GLY . 8.1 p-10 -32.21 110.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.761 0.315 . . . . 61.409999999999997 110.879 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.775 ' HA ' HG13 ' A' ' 121' ' ' VAL . 2.6 ppt_? -154.38 20.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 74.230000000000004 110.804 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.409 ' O ' HG22 ' A' ' 122' ' ' THR . 74.5 t -77.91 -68.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 45.520000000000003 111.119 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.724 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -85.83 -33.76 7.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 111.176 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.775 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -61.5 -42.46 94.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 61.299999999999997 111.147 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.537 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 5.2 t -63.89 -43.7 95.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.461 . . . . 62.229999999999997 111.133 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.461 ' N ' HG23 ' A' ' 122' ' ' THR . 1.8 ptm180 -74.88 -35.5 62.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 72.420000000000002 110.832 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 101' ' ' MET . 74.4 m-20 -75.48 -33.38 60.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.203 -0.453 . . . . 75.430000000000007 110.912 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.725 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -71.37 -44.26 65.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 73.209999999999994 110.901 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 44.7 t -59.95 -41.29 91.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.177 -0.465 . . . . 73.299999999999997 110.863 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -76.24 -55.82 5.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 54.130000000000003 110.951 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.995 HD11 HD12 ' A' ' 100' ' ' LEU . 3.1 tt -58.14 -48.41 84.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.166 -0.47 . . . . 71.349999999999994 111.092 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.725 HG23 ' O ' ' A' ' 125' ' ' CYS . 38.8 t -68.49 -33.15 58.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.11 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 1.7 t-20 -58.72 -38.29 77.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 110.882 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.682 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 5.4 t80 -74.34 -53.21 10.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.461 . . . . 74.010000000000005 110.873 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.791 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 0.6 OUTLIER -62.78 -55.49 26.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 71.120000000000005 110.895 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.571 ' CD2' ' HD3' ' A' ' 13' ' ' ARG . 3.0 t80 -48.69 -46.0 39.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 110.934 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.426 HD22 ' N ' ' A' ' 134' ' ' ASN . 1.0 OUTLIER -77.15 -29.01 54.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 75.0 110.874 -179.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.567 HD12 HD12 ' A' ' 132' ' ' LEU . 3.4 mt -57.88 -53.52 57.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 64.409999999999997 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.966 HD11 HG21 ' A' ' 12' ' ' THR . 0.0 OUTLIER -83.29 -13.88 54.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.192 -0.458 . . . . 73.340000000000003 110.916 179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.871 ' N ' HD13 ' A' ' 136' ' ' LEU . 13.3 tpp -96.3 23.9 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 65.129999999999995 110.936 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -85.18 172.57 47.56 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.733 -0.746 . . . . 42.310000000000002 112.521 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 48.4 mtp85 -56.62 -54.07 50.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.791 0.329 . . . . 72.030000000000001 110.865 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.501 ' CZ ' ' HB3' ' A' ' 81' ' ' LYS . 0.4 OUTLIER -79.29 -45.36 19.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 60.439999999999998 110.828 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.543 ' CG ' ' O ' ' A' ' 135' ' ' LEU . 37.2 m80 -56.07 -51.94 66.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.858 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.514 ' CD ' ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -66.25 -51.26 59.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.839 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.87 -46.0 51.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 71.140000000000001 111.064 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.423 ' HB3' ' CE1' ' A' ' 85' ' ' PHE . 5.0 tpt180 -76.29 -45.75 31.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 62.039999999999999 110.844 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.789 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -43.69 -46.81 7.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 74.129999999999995 110.939 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.721 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.29 -30.56 33.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 62.219999999999999 110.866 179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.94 -14.58 35.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 63.520000000000003 111.124 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.686 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.5 OUTLIER -110.1 24.13 13.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.465 . . . . 73.140000000000001 110.908 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.419 ' O ' ' OD2' ' A' ' 152' ' ' ASP . . . 97.85 4.29 57.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.736 -0.745 . . . . 52.340000000000003 112.423 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.488 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 45.94 -173.54 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.729 -0.748 . . . . 74.430000000000007 112.467 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.44 ' CD1' ' CD2' ' A' ' 8' ' ' LEU . 68.3 m95 -37.56 -48.91 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.809 0.337 . . . . 74.420000000000002 110.95 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.509 ' OD1' ' N ' ' A' ' 153' ' ' GLY . 0.3 OUTLIER -49.13 -42.34 39.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 74.010000000000005 110.882 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.509 ' N ' ' OD1' ' A' ' 152' ' ' ASP . . . -67.75 -28.41 73.51 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.686 -0.769 . . . . 71.340000000000003 112.543 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.725 ' CE1' HG11 ' A' ' 91' ' ' VAL . 2.3 t80 -67.86 -59.46 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.882 0.372 . . . . 70.049999999999997 110.82 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -37.1 39.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 55.530000000000001 110.914 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.56 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.23 -26.61 42.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 64.420000000000002 110.905 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 157' ' ' PHE . 7.2 t80 -74.07 -32.33 63.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 62.219999999999999 110.886 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.785 ' CD2' HG11 ' A' ' 45' ' ' VAL . 32.6 m-85 -102.59 -8.23 21.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 65.439999999999998 110.849 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.455 ' CA ' ' HE3' ' A' ' 159' ' ' LYS . 2.3 mmmt 65.45 76.34 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 63.439999999999998 110.888 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.775 ' OD1' HD22 ' A' ' 162' ' ' LEU . 16.5 t-20 -49.16 141.26 11.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.629 0.728 . . . . 75.230000000000004 110.885 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.476 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.74 -32.19 19.14 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.657 2.238 . . . . 64.409999999999997 112.361 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 1.057 ' O ' HD23 ' A' ' 162' ' ' LEU . 0.1 OUTLIER -57.66 161.46 6.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.656 0.741 . . . . 71.340000000000003 110.937 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 162' ' ' LEU . 54.2 Cg_endo -69.76 -42.33 3.5 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 55.130000000000003 112.373 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.408 ' O ' ' O ' ' A' ' 163' ' ' PRO . 3.1 mp -52.31 -171.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.26 -0.427 . . . . 72.519999999999996 110.866 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.552 0 N-CA-C 110.276 -1.13 . . . . 63.200000000000003 110.276 179.905 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . 0.402 ' CA ' ' H ' ' A' ' 2' ' ' ALA . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 110.289 -1.124 . . . . 54.0 110.289 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.83 -31.68 19.76 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.666 2.244 . . . . 43.200000000000003 112.306 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 1.6 tp -106.71 105.77 15.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 64.409999999999997 110.865 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 55.91 -105.16 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.693 -0.765 . . . . 72.519999999999996 112.499 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.3 t -133.93 75.08 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.843 0.354 . . . . 74.120000000000005 110.847 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.7 ttm -90.96 -53.95 4.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 51.509999999999998 110.888 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.402 ' H ' ' CA ' ' A' ' -5' ' ' GLY . . . -129.67 150.0 51.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 75.329999999999998 111.082 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -122.64 -5.96 8.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 64.420000000000002 110.849 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.9 m -92.24 -7.69 47.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 51.43 110.814 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -120.51 13.21 11.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 71.310000000000002 110.892 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.62 144.52 30.42 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.594 0.711 . . . . 73.319999999999993 110.862 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 -163.75 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.639 2.226 . . . . 74.129999999999995 112.341 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.03 HD22 ' NH2' ' A' ' 142' ' ' ARG . 0.4 OUTLIER -92.63 -25.98 18.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 75.25 110.924 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -54.56 -71.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 52.119999999999997 110.913 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -56.61 -13.89 2.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 60.450000000000003 110.891 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 2.8 ttp180 -74.54 -39.47 62.31 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.904 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.811 HG21 HD21 ' A' ' 136' ' ' LEU . 87.0 m -72.83 -48.14 40.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 62.32 111.139 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 3.5 tpt180 -56.47 -57.14 13.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 72.540000000000006 110.902 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.557 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -55.06 -44.36 74.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 63.039999999999999 110.859 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.753 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.2 OUTLIER -60.51 -52.11 66.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.922 -179.99 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HB3' HG13 ' A' ' 129' ' ' VAL . 6.6 mp -58.74 -50.96 71.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 72.230000000000004 110.937 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.71 -36.51 74.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 42.140000000000001 110.904 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD1' ' C ' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -56.59 -50.58 71.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 73.540000000000006 110.84 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.731 ' CE1' HG21 ' A' ' 46' ' ' THR . 66.6 t80 -54.28 -42.5 70.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 53.509999999999998 110.897 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.55 HG13 ' CG2' ' A' ' 129' ' ' VAL . 3.6 mm -53.65 -43.23 54.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.176 -0.466 . . . . 72.230000000000004 111.105 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.36 -40.38 90.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 75.099999999999994 110.926 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.469 ' CD1' ' HB3' ' A' ' 31' ' ' GLU . 5.5 m-85 -55.91 -57.7 10.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 74.120000000000005 110.906 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -61.89 -7.34 3.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 40.520000000000003 110.881 -179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.42 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -96.09 -14.3 22.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 50.32 111.09 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -70.62 111.26 5.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.219 -0.446 . . . . 55.350000000000001 110.911 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -41.29 156.44 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.568 0.699 . . . . 73.040000000000006 110.917 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -22.25 32.33 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.627 2.218 . . . . 71.319999999999993 112.322 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -78.02 4.22 12.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 34.25 110.881 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.434 ' O ' HG23 ' A' ' 29' ' ' THR . 1.5 t -146.03 126.08 6.98 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.546 0.689 . . . . 65.420000000000002 111.14 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 136.15 32.2 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.624 2.216 . . . . 63.329999999999998 112.359 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HB3' ' CD1' ' A' ' 22' ' ' PHE . 32.4 mt-10 -66.48 140.81 96.77 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.628 0.727 . . . . 64.530000000000001 110.905 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 171.8 13.81 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.715 2.277 . . . . 74.010000000000005 112.301 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 170.29 16.97 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.711 2.274 . . . . 64.219999999999999 112.304 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 174.0 10.14 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.717 2.278 . . . . 73.510000000000005 112.377 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.32 -34.6 4.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 74.349999999999994 111.159 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.569 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 13.2 p -128.16 176.3 7.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.237 -0.438 . . . . 51.439999999999998 110.794 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.442 HG23 ' H ' ' A' ' 37' ' ' VAL . 1.6 t -60.16 -49.38 84.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 75.109999999999999 111.154 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 15' ' ' LEU . 2.0 pm0 -65.88 -30.12 70.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 62.119999999999997 110.915 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.569 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -72.85 -27.76 62.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 75.140000000000001 111.152 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HB1' HD21 ' A' ' 160' ' ' ASN . . . -74.89 -53.04 9.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 73.239999999999995 111.139 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.896 HD23 ' HA ' ' A' ' 155' ' ' CYS . 0.0 OUTLIER -60.92 -53.94 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.291 -0.413 . . . . 72.420000000000002 110.952 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.075 HD13 HD23 ' A' ' 94' ' ' LEU . 69.1 mt -48.91 -47.58 43.24 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.965 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HD3' ' N ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -60.79 -26.19 67.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 65.129999999999995 110.861 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.457 ' N ' ' HD3' ' A' ' 43' ' ' ARG . 0.1 OUTLIER -87.36 -40.15 14.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.888 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.726 HG11 ' CD2' ' A' ' 158' ' ' PHE . 32.1 m -91.36 -55.84 5.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 65.200000000000003 111.149 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.731 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.6 OUTLIER -50.0 -34.87 22.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 111.151 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.509 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.46 -33.77 74.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 62.409999999999997 110.798 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -79.04 -30.85 44.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.215 -0.448 . . . . 74.099999999999994 110.893 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.577 HG21 ' HG2' ' A' ' 92' ' ' MET . 18.2 mm -62.02 -32.03 53.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 74.340000000000003 111.091 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.704 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.4 mt-30 -80.57 -60.67 2.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 51.100000000000001 110.928 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -48.36 -19.71 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.230000000000004 110.922 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.583 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 17.3 pt-20 -96.77 -41.91 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.899 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.612 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.0 m-70 -103.09 -44.3 5.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.146 -0.479 . . . . 75.549999999999997 110.824 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -37.94 -24.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 74.430000000000007 110.879 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.34 -32.6 4.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 63.130000000000003 110.919 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -102.58 -40.6 6.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.08 -0.509 . . . . 74.409999999999997 110.855 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.612 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.98 -53.27 52.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 73.239999999999995 110.923 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 t -49.4 -45.03 45.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 71.150000000000006 110.852 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.8 t -52.88 -38.82 62.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.091 -0.504 . . . . 74.129999999999995 110.89 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -77.31 -42.51 36.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.140000000000001 110.867 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.3 m -51.4 -24.43 4.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.091 -0.504 . . . . 71.120000000000005 110.859 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -121.77 29.45 7.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.400000000000006 110.842 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 t -118.04 -68.22 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 72.420000000000002 110.859 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 66' ' ' ASN . 0.2 OUTLIER -91.88 -17.24 25.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.076 -0.511 . . . . 75.120000000000005 110.864 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.49 0.29 72.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.764 -0.732 . . . . 72.409999999999997 112.495 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.896 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -83.49 31.12 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.371 . . . . 55.409999999999997 110.943 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.812 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -32.65 -34.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 31.239999999999998 110.902 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.557 HD13 HD13 ' A' ' 127' ' ' LEU . 1.8 tp -77.69 -51.28 10.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 74.040000000000006 110.926 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.1 mm-40 -48.54 -35.24 12.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.917 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.896 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -76.89 -36.65 56.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.926 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.987 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.18 -45.66 92.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 62.130000000000003 111.151 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.688 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 1.8 ptpt -72.86 -43.92 61.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.891 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.5 mp0 -55.23 -49.53 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 61.509999999999998 110.858 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.721 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 12.6 mmm -56.73 -55.78 29.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 71.109999999999999 110.84 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.588 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.62 -22.02 3.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 71.200000000000003 111.051 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -83.43 -29.73 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.238 -0.437 . . . . 74.319999999999993 110.905 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.918 ' HG2' HD23 ' A' ' 78' ' ' LEU . 8.7 ptpt -80.23 -48.42 13.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 65.420000000000002 110.914 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.918 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.61 -55.34 4.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 75.439999999999998 110.891 179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.867 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -93.94 158.43 15.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.212 -0.449 . . . . 74.019999999999996 110.929 179.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.465 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -163.98 -175.17 3.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 61.420000000000002 110.816 -179.882 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.465 ' CB ' ' HD3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -101.19 -36.72 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 71.430000000000007 110.919 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' CG ' ' NH2' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -104.54 -7.87 19.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 71.340000000000003 110.874 179.844 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.621 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -87.73 127.82 35.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 50.299999999999997 110.881 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -66.4 72.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 65.299999999999997 110.836 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.816 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.51 174.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.040000000000006 110.868 -179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -142.49 158.01 44.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 74.299999999999997 110.885 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.993 ' CE3' HD12 ' A' ' 90' ' ' LEU . 5.4 m95 -50.6 -37.03 37.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.929 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.73 -32.4 71.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.275 -0.421 . . . . 75.430000000000007 110.82 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.1 mm100 -74.86 -39.74 61.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 74.239999999999995 110.895 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.993 HD12 ' CE3' ' A' ' 87' ' ' TRP . 7.4 mt -57.89 -54.19 49.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.947 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.819 HG12 HD23 ' A' ' 42' ' ' LEU . 23.7 m -63.11 -31.55 53.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 62.549999999999997 111.125 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.577 ' HG2' HG21 ' A' ' 49' ' ' ILE . 2.7 tmm? -68.0 -42.75 80.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 110.878 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.574 HD11 ' HG ' ' A' ' 132' ' ' LEU . 3.0 tp -57.47 -44.97 85.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 40.420000000000002 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.075 HD23 HD13 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -61.8 -42.47 99.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 75.230000000000004 110.874 179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.505 ' O ' ' NE2' ' A' ' 50' ' ' GLN . . . -55.9 -58.69 6.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 62.210000000000001 111.061 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.987 ' CE2' HD11 ' A' ' 100' ' ' LEU . 61.3 t80 -52.7 -60.84 2.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 73.120000000000005 110.879 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.845 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -36.33 -51.61 0.8 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 73.209999999999994 111.074 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.511 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -67.4 -30.63 75.44 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.774 -0.726 . . . . 71.420000000000002 112.479 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.677 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -68.56 -25.82 65.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.847 0.356 . . . . 65.310000000000002 111.177 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.987 HD11 ' CE2' ' A' ' 96' ' ' PHE . 4.5 mt -83.68 -35.83 24.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 61.210000000000001 110.927 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 20' ' ' ILE . 9.5 tpp -35.37 99.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 73.510000000000005 110.824 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.4 OUTLIER -70.43 161.59 30.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.010000000000005 110.903 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.435 ' NE2' ' HB ' ' A' ' 121' ' ' VAL . 51.8 mm-40 -146.02 121.86 10.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 74.120000000000005 110.902 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.443 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -175.16 52.87 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.705 -0.759 . . . . 54.119999999999997 112.493 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.1 Cg_endo -69.75 -162.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.678 2.252 . . . . 73.400000000000006 112.321 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.606 ' O ' ' CD1' ' A' ' 106' ' ' TYR . 4.6 t80 -123.86 -6.67 7.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 110.918 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.452 ' CE ' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -36.61 94.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.103 -0.499 . . . . 72.230000000000004 110.869 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -99.76 -151.13 0.39 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.400000000000006 111.128 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.616 HG13 ' N ' ' A' ' 110' ' ' LYS . 8.4 p -80.62 -52.66 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 54.299999999999997 111.163 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.616 ' N ' HG13 ' A' ' 109' ' ' VAL . 2.7 mptt -85.31 84.06 7.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.164 -0.471 . . . . 72.129999999999995 110.914 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -143.72 158.84 43.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.872 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -67.6 -30.36 69.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 74.450000000000003 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 63.1 mtm180 -137.21 178.38 7.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 62.340000000000003 110.873 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.471 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 0.0 OUTLIER -130.42 -67.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 62.119999999999997 110.893 179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -67.98 -9.7 47.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 60.140000000000001 110.912 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.425 ' N ' HD12 ' A' ' 115' ' ' LEU . . . -79.71 62.21 4.17 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.692 -0.766 . . . . 73.230000000000004 112.458 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.612 ' O ' HG11 ' A' ' 121' ' ' VAL . 6.0 p-10 -99.65 68.99 1.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.797 0.332 . . . . 52.25 110.873 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.782 ' HA ' HG13 ' A' ' 121' ' ' VAL . 0.0 OUTLIER -113.94 36.6 3.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.883 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.417 ' O ' HG22 ' A' ' 122' ' ' THR . 70.5 t -79.27 -68.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.267 -0.424 . . . . 75.409999999999997 111.195 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.795 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -86.29 -36.83 10.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 74.420000000000002 111.103 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.782 HG13 ' HA ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -58.97 -41.72 83.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.148 -0.478 . . . . 74.439999999999998 111.093 179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.514 ' CG2' ' O ' ' A' ' 118' ' ' ARG . 4.9 t -63.99 -42.88 97.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.186 -0.461 . . . . 71.140000000000001 111.121 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 122' ' ' THR . 0.0 OUTLIER -75.17 -35.38 61.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 73.409999999999997 110.905 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.531 ' HA ' HD21 ' A' ' 127' ' ' LEU . 3.7 m-20 -75.56 -33.3 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 73.25 110.799 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.724 ' O ' HG23 ' A' ' 129' ' ' VAL . 14.7 p -70.92 -39.28 72.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 64.530000000000001 110.83 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 53.0 t -62.22 -49.75 74.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 51.219999999999999 110.867 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.998 HD12 ' N ' ' A' ' 128' ' ' ILE . 4.0 pp -66.4 -54.12 27.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.239 -0.437 . . . . 73.329999999999998 110.975 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.998 ' N ' HD12 ' A' ' 127' ' ' LEU . 4.0 tt -56.47 -47.89 80.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 73.040000000000006 111.137 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 16' ' ' LEU . 61.5 t -71.16 -32.5 47.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 64.510000000000005 111.127 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.12 -40.36 76.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 70.319999999999993 110.872 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.688 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 10.0 t80 -69.94 -55.37 9.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 61.25 110.925 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.845 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 6.9 mp -61.22 -55.74 28.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 64.120000000000005 110.892 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.576 ' CE1' ' HB2' ' A' ' 13' ' ' ARG . 41.8 t80 -44.81 -41.23 6.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.951 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.48 ' ND2' ' HA ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -77.49 -27.16 51.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.109 -0.496 . . . . 71.129999999999995 110.905 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.588 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.2 OUTLIER -62.04 -54.93 34.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.218 -0.446 . . . . 71.129999999999995 110.896 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.811 HD21 HG21 ' A' ' 12' ' ' THR . 0.4 OUTLIER -82.25 1.64 35.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 65.349999999999994 110.908 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.583 ' CE ' ' NH1' ' A' ' 142' ' ' ARG . 21.8 mmt -104.11 24.67 11.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.157 -0.474 . . . . 70.200000000000003 110.839 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 142' ' ' ARG . . . -89.16 144.5 18.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.789 -0.72 . . . . 63.130000000000003 112.488 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.55 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 5.5 mmt180 -44.99 -49.28 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.784 0.326 . . . . 60.200000000000003 110.889 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 81' ' ' LYS . 7.8 ptm180 -79.21 -49.46 12.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 71.319999999999993 110.928 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.718 ' NE2' HD12 ' A' ' 79' ' ' LEU . 17.8 t-80 -58.62 -63.63 1.22 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.153 -0.476 . . . . 64.420000000000002 110.864 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 1.03 ' NH2' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.58 -51.21 63.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.299999999999997 110.908 -179.92 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.55 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -47.39 -37.83 12.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 44.43 111.131 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.504 ' O ' ' CD2' ' A' ' 148' ' ' LEU . 0.0 OUTLIER -76.25 -38.13 56.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.16 -0.473 . . . . 63.329999999999998 110.881 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.903 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.0 OUTLIER -57.68 -42.97 84.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.199 -0.455 . . . . 55.450000000000003 110.879 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.903 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.8 OUTLIER -82.03 -31.87 30.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.261 -0.427 . . . . 72.340000000000003 110.916 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.76 -15.22 18.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 34.020000000000003 111.086 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.692 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -109.63 27.15 9.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 75.430000000000007 110.87 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.32 4.44 62.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.758 -0.734 . . . . 72.25 112.542 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.492 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 46.32 -171.43 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 64.099999999999994 112.454 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.843 ' CD1' HD21 ' A' ' 8' ' ' LEU . 70.9 m95 -37.52 -35.04 0.11 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.797 0.332 . . . . 71.510000000000005 110.887 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.448 ' C ' ' OD1' ' A' ' 152' ' ' ASP . 0.6 OUTLIER -59.05 -47.49 85.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 65.340000000000003 110.83 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -63.41 -31.34 80.41 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.666 -0.778 . . . . 61.509999999999998 112.552 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.723 ' CE1' HG11 ' A' ' 91' ' ' VAL . 7.5 t80 -67.32 -52.69 37.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 73.430000000000007 110.867 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.896 ' HA ' HD23 ' A' ' 41' ' ' LEU . 8.6 p -51.92 -37.63 53.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.217 -0.447 . . . . 62.100000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.567 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -80.48 -26.62 38.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.462 . . . . 72.219999999999999 110.847 -179.863 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -67.88 -45.49 74.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.241 -0.436 . . . . 72.340000000000003 110.84 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.726 ' CD2' HG11 ' A' ' 45' ' ' VAL . 2.5 m-85 -92.94 -3.12 55.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.466 . . . . 62.020000000000003 110.942 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 6.3 mptt 53.3 86.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 61.43 110.927 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.898 HD22 HD12 ' A' ' 162' ' ' LEU . 1.9 t30 -48.1 146.47 4.31 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.679 0.752 . . . . 61.130000000000003 110.868 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.492 ' HD2' ' ND2' ' A' ' 160' ' ' ASN . 54.2 Cg_endo -69.74 -38.08 8.33 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.716 2.277 . . . . 75.099999999999994 112.345 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 1.079 HD13 ' O ' ' A' ' 162' ' ' LEU . 0.0 OUTLIER -58.12 153.09 37.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.6 0.714 . . . . 73.409999999999997 110.882 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.698 ' N ' HD22 ' A' ' 162' ' ' LEU . 53.9 Cg_endo -69.76 -89.08 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.64 2.227 . . . . 53.210000000000001 112.348 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.921 HD23 ' O ' ' A' ' 164' ' ' LEU . 0.3 OUTLIER -110.99 150.87 28.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.223 -0.444 . . . . 73.140000000000001 110.956 179.917 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.528 0 N-CA-C 110.287 -1.125 . . . . 70.150000000000006 110.287 179.935 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.605 0 N-CA-C 110.275 -1.13 . . . . 74.010000000000005 110.275 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' A' ' -2' ' ' GLY . 53.9 Cg_endo -69.74 -90.83 0.01 OUTLIER 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.676 2.25 . . . . 72.340000000000003 112.395 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 5.8 tp 38.78 26.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.21 -0.45 . . . . 70.329999999999998 110.928 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.49 ' N ' ' O ' ' A' ' -4' ' ' PRO . . . 151.22 33.78 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.739 -0.743 . . . . 62.32 112.451 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.9 m -105.74 106.46 16.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.877 0.37 . . . . 54.450000000000003 110.86 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.507 ' CG ' ' N ' ' A' ' 2' ' ' ALA . 1.7 ptt? -90.98 -48.14 7.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 61.520000000000003 110.878 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.507 ' N ' ' CG ' ' A' ' 1' ' ' MET . . . -169.19 145.86 3.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.151 -0.477 . . . . 54.149999999999999 111.018 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -81.91 -52.79 6.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.129999999999995 110.84 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.51 ' O ' ' N ' ' A' ' 6' ' ' ASP . 59.5 p -69.21 -33.71 73.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 64.310000000000002 110.863 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 38.59 25.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.136 -0.484 . . . . 75.109999999999999 110.939 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' SER . 0.7 OUTLIER -71.46 131.78 86.21 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.532 0.682 . . . . 71.019999999999996 110.888 179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -15.74 37.24 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.695 2.264 . . . . 75.409999999999997 112.327 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.562 HD11 ' HD1' ' A' ' 151' ' ' TRP . 7.0 tp -98.01 -1.18 43.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 75.530000000000001 110.893 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.69 ' CD2' ' N ' ' A' ' 10' ' ' GLU . 0.5 OUTLIER -71.62 -54.33 10.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 75.400000000000006 110.849 179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.69 ' N ' ' CD2' ' A' ' 9' ' ' HIS . 9.0 tm-20 -74.93 -15.19 60.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 74.439999999999998 110.882 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.436 ' HG3' ' NH1' ' A' ' 14' ' ' ARG . 5.7 ttt85 -75.25 -39.0 60.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.167 -0.469 . . . . 72.120000000000005 110.863 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 m -75.54 -54.32 7.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.400000000000006 111.14 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.551 ' HB2' ' CD2' ' A' ' 133' ' ' TYR . 7.2 tpt180 -51.35 -56.79 11.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 110.909 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -54.69 -46.11 74.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 73.540000000000006 110.814 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.8 -51.65 68.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.231 -0.441 . . . . 71.129999999999995 110.972 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.864 ' HB3' HG23 ' A' ' 129' ' ' VAL . 7.4 mp -58.79 -53.47 58.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 65.129999999999995 110.89 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.5 t -53.45 -33.02 52.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.450000000000003 110.846 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -63.95 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.229 -0.441 . . . . 75.25 110.855 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.728 ' CE1' HG21 ' A' ' 46' ' ' THR . 86.7 t80 -71.49 -20.12 62.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 74.310000000000002 110.971 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.652 HG21 ' HA ' ' A' ' 125' ' ' CYS . 2.5 mm -76.71 -44.33 33.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 111.135 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -61.39 -48.42 81.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 73.0 110.833 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 32' ' ' PRO . 9.1 m-30 -56.04 -51.62 67.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 74.400000000000006 110.907 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -7.64 10.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.872 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 1.027 ' HB1' ' NE2' ' A' ' 103' ' ' GLN . . . -108.85 -11.96 14.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 111.092 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' CB ' ' CD ' ' A' ' 31' ' ' GLU . 2.9 mmt85 -72.24 113.13 8.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 64.019999999999996 110.82 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' A' ' 25' ' ' ARG . 56.6 mm-40 -28.87 143.01 0.06 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.663 0.744 . . . . 62.130000000000003 110.884 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 -17.21 37.25 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 71.239999999999995 112.352 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -76.45 4.62 8.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.242 -0.435 . . . . 74.019999999999996 110.877 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.451 ' O ' ' CG2' ' A' ' 29' ' ' THR . 1.4 t -150.64 124.88 4.52 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.586 0.708 . . . . 75.109999999999999 111.178 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 134.87 29.09 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.259 . . . . 60.310000000000002 112.4 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' ' CB ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -74.33 155.74 87.68 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.652 0.739 . . . . 62.520000000000003 110.896 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 53.8 Cg_endo -69.78 170.6 16.21 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 2.26 . . . . 64.109999999999999 112.315 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.66 170.96 15.23 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.73 2.287 . . . . 72.450000000000003 112.313 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 177.08 5.98 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.624 2.216 . . . . 54.43 112.369 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.54 -28.25 6.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 71.140000000000001 111.083 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.456 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 2.1 p -137.28 166.92 22.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.271 -0.422 . . . . 44.32 110.844 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.1 t -50.25 -48.85 24.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 111.104 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 15' ' ' LEU . 1.2 pm0 -60.57 -32.51 71.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 62.119999999999997 110.839 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.65 -32.96 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 62.310000000000002 111.065 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.91 -52.28 11.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.278 -0.419 . . . . 72.219999999999999 111.077 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.952 HD22 ' HA ' ' A' ' 160' ' ' ASN . 0.1 OUTLIER -59.95 -54.09 50.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.445 . . . . 61.130000000000003 110.938 -179.947 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.946 HD22 HD12 ' A' ' 94' ' ' LEU . 75.1 mt -49.37 -46.83 47.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.019999999999996 110.911 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -60.41 -26.12 66.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 54.210000000000001 110.869 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.03 -40.43 13.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 61.530000000000001 110.84 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.648 HG23 ' N ' ' A' ' 46' ' ' THR . 27.7 m -90.02 -56.26 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.493 . . . . 63.020000000000003 111.102 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.728 HG21 ' CE1' ' A' ' 19' ' ' TYR . 0.5 OUTLIER -50.38 -36.38 32.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 53.200000000000003 111.155 -179.961 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.51 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -61.81 -32.3 72.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 61.130000000000003 110.872 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.53 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -79.67 -32.09 41.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 74.540000000000006 110.906 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.53 HD13 ' HG3' ' A' ' 48' ' ' GLN . 13.6 mm -61.81 -31.95 52.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 73.099999999999994 111.132 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.706 ' O ' ' N ' ' A' ' 54' ' ' GLN . 2.7 mt-30 -80.93 -60.73 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 75.430000000000007 110.857 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -47.5 -20.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.421 . . . . 75.219999999999999 110.887 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 8.7 pt-20 -97.2 -41.16 8.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.191 -0.459 . . . . 73.019999999999996 110.894 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.608 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 97.6 m-70 -103.03 -44.56 5.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 70.310000000000002 110.879 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.706 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -38.11 -24.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.141 -0.481 . . . . 54.409999999999997 110.922 -179.907 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.555 ' N ' ' O ' ' A' ' 53' ' ' HIS . 1.9 mt-10 -47.19 -32.23 4.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.898 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -103.38 -40.18 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.166 -0.47 . . . . 75.25 110.864 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.608 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 12.2 m-85 -52.86 -52.36 57.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.104 -0.498 . . . . 75.549999999999997 110.956 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.6 t -49.89 -46.79 52.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.488 . . . . 34.149999999999999 110.863 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -52.22 -36.43 52.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.857 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.44 -41.94 45.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 74.209999999999994 110.83 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.438 ' SG ' ' CG ' ' A' ' 62' ' ' GLU . 0.8 OUTLIER -50.32 -22.81 1.97 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.884 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.438 ' CG ' ' SG ' ' A' ' 61' ' ' CYS . 4.4 mt-10 -122.28 32.32 5.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.466 . . . . 73.120000000000005 110.929 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.9 t -118.25 -68.22 0.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 63.340000000000003 110.859 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.5 ' O ' ' ND2' ' A' ' 66' ' ' ASN . 11.5 mmt180 -98.35 -14.22 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 72.319999999999993 110.889 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.5 ' O ' ' CD ' ' A' ' 67' ' ' ARG . . . 73.1 7.5 71.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.781 -0.724 . . . . 74.310000000000002 112.487 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.937 ' O ' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -86.48 30.94 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.783 0.325 . . . . 64.120000000000005 110.893 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.709 ' O ' HD13 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -32.68 -34.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 65.010000000000005 110.935 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.4 tp -78.56 -51.29 10.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.176 -0.465 . . . . 74.049999999999997 110.9 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 74.5 mt-10 -50.71 -33.08 21.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 64.120000000000005 110.908 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.937 HD22 ' O ' ' A' ' 66' ' ' ASN . 0.1 OUTLIER -78.42 -36.46 45.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 65.519999999999996 110.936 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 1.004 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -58.02 -46.18 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 73.519999999999996 111.119 179.838 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.705 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 4.0 ptpt -71.69 -45.31 62.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 61.020000000000003 110.919 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.519 ' O ' ' CD ' ' A' ' 77' ' ' LYS . 2.3 mp0 -58.56 -52.53 65.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.248 -0.433 . . . . 75.299999999999997 110.946 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.655 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 4.3 mmm -56.23 -33.05 65.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 72.099999999999994 110.927 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.507 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -68.48 -28.65 67.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.265 -0.425 . . . . 65.349999999999994 111.096 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.53 -47.68 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.842 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 74' ' ' MET . 0.0 OUTLIER -53.37 -47.11 69.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.319999999999993 110.927 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.756 HD12 HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -90.37 -63.07 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.153 -0.476 . . . . 71.519999999999996 110.918 179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.756 HD23 HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER -85.15 154.97 21.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 75.310000000000002 110.867 179.883 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 83' ' ' GLN . 0.3 OUTLIER -169.36 -161.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 65.430000000000007 110.925 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -100.64 -52.39 3.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.540000000000006 110.901 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.507 ' C ' ' NE2' ' A' ' 83' ' ' GLN . 16.3 m-20 -96.48 12.31 31.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 63.539999999999999 110.905 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.582 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -101.1 127.63 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 61.25 110.953 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 84' ' ' ASP . 22.2 p-10 -69.74 69.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 63.100000000000001 110.892 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.812 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -51.12 118.58 3.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 73.340000000000003 110.847 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.3 p -85.51 157.95 20.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 61.43 110.835 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CE2' ' CD1' ' A' ' 148' ' ' LEU . 5.1 m95 -48.79 -38.12 21.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.1 -0.5 . . . . 63.409999999999997 110.94 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -59.7 -29.4 68.07 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.168 -0.469 . . . . 63.32 110.906 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 9.5 mm100 -72.66 -46.98 51.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.946 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.889 ' HA ' HD23 ' A' ' 93' ' ' LEU . 4.0 mm? -50.36 -55.47 15.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 74.109999999999999 110.907 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.79 HG12 HD23 ' A' ' 42' ' ' LEU . 27.0 m -62.71 -30.64 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 61.32 111.161 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.435 ' HG2' HG21 ' A' ' 49' ' ' ILE . 1.6 tmm? -67.48 -42.37 83.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 75.519999999999996 110.861 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -60.08 -35.55 75.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.965 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.946 HD12 HD22 ' A' ' 42' ' ' LEU . 8.9 mt -72.06 -45.04 62.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.145 -0.48 . . . . 64.329999999999998 110.95 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.535 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -55.35 -58.04 9.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 63.229999999999997 111.179 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 1.023 ' CE2' HD11 ' A' ' 100' ' ' LEU . 64.6 t80 -50.71 -59.58 3.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 75.109999999999999 110.885 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.958 ' HB2' ' CD2' ' A' ' 132' ' ' LEU . . . -38.53 -50.75 1.59 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 111.144 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.47 ' HA3' ' CE2' ' A' ' 19' ' ' TYR . . . -64.55 -29.23 74.58 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.751 . . . . 72.129999999999995 112.555 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.627 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.6 OUTLIER -73.62 -27.41 61.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.838 0.351 . . . . 71.209999999999994 111.126 -179.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.023 HD11 ' CE2' ' A' ' 96' ' ' PHE . 5.2 mt -80.28 -36.06 35.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 72.439999999999998 110.945 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.651 ' HG2' ' HB2' ' A' ' 24' ' ' ALA . 5.5 tpp -33.23 98.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.864 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.481 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -72.91 152.92 41.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 71.129999999999995 110.918 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.027 ' NE2' ' HB1' ' A' ' 24' ' ' ALA . 19.7 mm-40 -144.46 93.04 2.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 75.0 110.975 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -150.21 71.33 0.3 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.713 -0.756 . . . . 72.030000000000001 112.551 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -162.91 0.1 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.724 2.283 . . . . 54.25 112.327 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 107' ' ' MET . 1.5 p90 -123.28 -67.91 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.95 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.662 ' HE2' ' HA ' ' A' ' 107' ' ' MET . 0.0 OUTLIER -130.32 73.54 1.54 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 62.219999999999999 110.851 179.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -77.08 96.9 4.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 52.350000000000001 111.109 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 110' ' ' LYS . 11.9 p -151.44 -52.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 52.210000000000001 111.119 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.614 ' N ' HG13 ' A' ' 109' ' ' VAL . 0.0 OUTLIER -100.11 77.6 2.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 63.229999999999997 110.92 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -133.94 161.28 35.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.230000000000004 110.876 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 113' ' ' ARG . 14.1 tptt -131.51 95.0 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 71.239999999999995 110.903 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.419 ' C ' ' O ' ' A' ' 112' ' ' LYS . 33.1 ttp85 -34.78 97.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 74.5 110.919 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 112' ' ' LYS . 5.1 t70 -123.78 -57.69 1.62 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 73.530000000000001 110.841 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.606 HD12 ' N ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -99.9 -12.37 19.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 74.040000000000006 110.911 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.606 ' N ' HD12 ' A' ' 115' ' ' LEU . . . 170.52 -138.46 4.99 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.753 -0.737 . . . . 41.140000000000001 112.504 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.632 ' CG ' HG11 ' A' ' 121' ' ' VAL . 3.9 p-10 -110.62 -29.77 7.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.351 . . . . 72.329999999999998 110.903 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.876 ' O ' HG22 ' A' ' 122' ' ' THR . 5.0 tpp180 -151.57 171.66 17.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.420000000000002 110.864 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.501 HG23 ' N ' ' A' ' 120' ' ' ILE . 27.5 m -78.09 -45.23 27.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.465 . . . . 55.439999999999998 111.194 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.887 HD13 ' H ' ' A' ' 121' ' ' VAL . 0.1 OUTLIER -69.41 -33.34 56.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 73.230000000000004 111.138 179.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.887 ' H ' HD13 ' A' ' 120' ' ' ILE . 5.8 p -71.94 -47.72 54.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 70.150000000000006 111.146 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.876 HG22 ' O ' ' A' ' 118' ' ' ARG . 5.1 t -68.2 -45.0 74.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 54.119999999999997 111.086 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.837 ' O ' HD13 ' A' ' 127' ' ' LEU . 7.4 ptm180 -58.91 -48.57 80.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.349999999999994 110.817 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.494 ' OD1' ' CZ ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -75.64 -26.16 57.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.893 179.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.904 ' O ' HG12 ' A' ' 129' ' ' VAL . 0.6 OUTLIER -62.28 -48.67 78.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 53.329999999999998 110.86 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.461 ' HA ' ' CG1' ' A' ' 129' ' ' VAL . 1.6 t -70.15 -37.62 75.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 64.150000000000006 110.889 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 123' ' ' ARG . 8.2 mp -67.03 -48.76 67.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.919 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 1.004 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.4 tt -64.62 -47.14 90.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 72.109999999999999 111.139 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.904 HG12 ' O ' ' A' ' 125' ' ' CYS . 9.8 p -69.06 -31.98 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 73.010000000000005 111.135 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -47.31 80.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 62.109999999999999 110.842 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.705 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 15.5 t80 -63.71 -55.68 21.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 75.420000000000002 110.92 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.958 ' CD2' ' HB2' ' A' ' 97' ' ' ALA . 1.6 mp -58.02 -55.22 37.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 71.209999999999994 110.928 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.598 ' CD2' ' HG3' ' A' ' 137' ' ' MET . 0.7 OUTLIER -42.92 -52.77 5.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.959 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.439 ' N ' ' CD1' ' A' ' 133' ' ' TYR . 19.1 m-20 -68.46 -27.49 66.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.083 -0.508 . . . . 74.209999999999994 110.851 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.611 ' O ' ' CD2' ' A' ' 141' ' ' HIS . 0.0 OUTLIER -56.77 -42.51 79.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 63.039999999999999 110.947 179.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.861 HD23 ' H ' ' A' ' 136' ' ' LEU . 1.8 pt? -101.54 -22.99 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.918 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.598 ' HG3' ' CD2' ' A' ' 133' ' ' TYR . 32.4 mmt -82.6 23.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.466 . . . . 71.209999999999994 110.876 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.585 ' HA3' ' CD2' ' A' ' 141' ' ' HIS . . . -88.2 173.08 42.37 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.721 -0.752 . . . . 74.040000000000006 112.504 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' ALA . 6.9 mtm180 -60.52 -53.63 55.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 110.863 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.422 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 4.7 ptp180 -78.66 -38.87 38.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 73.209999999999994 110.942 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.611 ' CD2' ' O ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -64.33 -57.38 9.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 110.891 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.496 ' HE ' HD23 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -61.88 -48.71 79.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.540000000000006 110.852 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 139' ' ' ARG . . . -49.79 -43.62 48.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 75.239999999999995 111.152 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 19.3 tpt180 -76.66 -48.22 19.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 75.120000000000005 110.843 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 145' ' ' LEU . 0.2 OUTLIER -42.99 -46.57 5.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.225 -0.443 . . . . 62.009999999999998 110.907 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.765 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -80.83 -30.13 35.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 63.329999999999998 110.916 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.14 -14.62 38.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 64.109999999999999 111.119 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.703 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.7 OUTLIER -109.96 22.56 15.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 103.6 -7.65 50.5 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.713 -0.756 . . . . 44.5 112.473 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 152' ' ' ASP . . . 54.17 -175.6 0.43 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.806 -0.712 . . . . 74.340000000000003 112.446 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . 0.562 ' HD1' HD11 ' A' ' 8' ' ' LEU . 76.1 m95 -38.85 -26.01 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.917 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 150' ' ' GLY . 7.0 t0 -66.96 -47.92 70.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.911 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 150' ' ' GLY . . . -65.1 -25.51 70.98 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.719 -0.753 . . . . 44.43 112.505 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.615 ' CE2' ' HB3' ' A' ' 41' ' ' LEU . 2.8 t80 -67.17 -57.56 6.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.864 0.364 . . . . 72.540000000000006 110.837 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.761 ' HA ' HD23 ' A' ' 41' ' ' LEU . 18.5 p -51.77 -39.27 58.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.171 -0.468 . . . . 75.420000000000002 110.859 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.564 ' CD ' ' C ' ' A' ' 156' ' ' ARG . 0.0 OUTLIER -79.8 -26.64 40.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 53.509999999999998 110.885 -179.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.416 ' HD1' ' CD1' ' A' ' 158' ' ' PHE . 32.5 t80 -70.03 -44.15 69.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 62.439999999999998 110.88 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.577 ' CD2' HG11 ' A' ' 45' ' ' VAL . 51.4 m-85 -92.39 -9.18 42.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 75.540000000000006 110.891 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? 65.69 81.0 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 73.340000000000003 110.934 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.952 ' HA ' HD22 ' A' ' 41' ' ' LEU . 3.8 t30 -48.98 140.15 11.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 60.210000000000001 110.923 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.68 -39.09 7.08 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.696 2.264 . . . . 73.319999999999993 112.355 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.4 ' H ' ' ND2' ' A' ' 160' ' ' ASN . 0.5 OUTLIER -102.82 159.2 30.03 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.616 0.722 . . . . 60.039999999999999 110.921 179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 -90.35 0.0 OUTLIER 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.631 2.221 . . . . 71.340000000000003 112.331 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.64 -178.53 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 74.409999999999997 110.883 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.509 0 N-CA-C 110.247 -1.141 . . . . 72.109999999999999 110.247 179.902 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 74.329999999999998 110.295 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 -4.29 13.66 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.741 2.294 . . . . 73.150000000000006 112.336 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' LEU . . . . . . . . . . . . . 7.5 tp -44.64 112.95 0.48 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 74.519999999999996 110.961 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 151.46 148.64 4.86 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.742 -0.742 . . . . 55.240000000000002 112.445 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 47.2 t -165.59 116.33 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.902 0.382 . . . . 43.219999999999999 110.899 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.492 ' SD ' ' CB ' ' A' ' 2' ' ' ALA . 2.8 ppp? -78.19 -41.7 33.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 64.150000000000006 110.851 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.492 ' CB ' ' SD ' ' A' ' 1' ' ' MET . . . -145.46 167.77 22.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 61.210000000000001 111.032 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -126.8 -44.98 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 52.43 110.883 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.04 62.89 0.7 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 73.019999999999996 110.858 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.68 -17.8 17.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 71.109999999999999 110.923 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.421 ' CB ' ' HD3' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -110.98 165.96 11.69 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.613 0.721 . . . . 61.450000000000003 110.895 179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.502 ' O ' ' CD ' ' A' ' 11' ' ' ARG . 54.3 Cg_endo -69.73 -165.31 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.658 2.238 . . . . 60.399999999999999 112.388 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.728 HD22 HH12 ' A' ' 142' ' ' ARG . 0.1 OUTLIER -92.09 -21.5 20.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.214 -0.448 . . . . 71.120000000000005 110.938 179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.498 ' ND1' ' N ' ' A' ' 10' ' ' GLU . 9.1 t-80 -59.01 -83.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 74.439999999999998 110.837 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.498 ' N ' ' ND1' ' A' ' 9' ' ' HIS . 10.3 tp10 -53.66 -16.66 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.109999999999999 110.885 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.502 ' CD ' ' O ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -73.26 -31.84 64.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.468 . . . . 73.140000000000001 110.866 -179.852 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.959 HG21 HD11 ' A' ' 136' ' ' LEU . 19.4 m -80.62 -48.81 12.12 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 72.530000000000001 111.099 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB2' ' CE1' ' A' ' 133' ' ' TYR . 2.7 tpt180 -59.85 -43.09 94.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 72.099999999999994 110.899 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' CD ' ' N ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -64.79 -46.48 81.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.226 -0.443 . . . . 73.040000000000006 110.839 -179.886 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.739 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -60.35 -52.15 66.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 55.130000000000003 110.918 179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 94' ' ' LEU . 3.3 mp -59.21 -52.06 67.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 64.510000000000005 110.867 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.5 m -60.31 -35.0 74.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.229999999999997 110.856 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.27 -40.13 77.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 52.049999999999997 110.861 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.55 ' CE1' HG21 ' A' ' 46' ' ' THR . 62.6 t80 -70.71 -38.59 73.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 72.120000000000005 110.956 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.934 HG23 ' HG3' ' A' ' 101' ' ' MET . 23.6 mm -50.64 -46.15 27.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 55.329999999999998 111.111 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -66.53 -48.51 69.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 65.310000000000002 110.931 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.576 ' CE2' ' HB2' ' A' ' 31' ' ' GLU . 0.4 OUTLIER -57.21 -38.35 73.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 75.409999999999997 110.938 -179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -67.42 -34.79 77.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 71.450000000000003 110.852 -179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.704 ' HB1' ' CG ' ' A' ' 103' ' ' GLN . . . -72.66 -8.46 55.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 65.140000000000001 111.115 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' CG ' ' O ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -32.47 111.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 63.5 110.891 -179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.623 ' HB2' HG22 ' A' ' 29' ' ' THR . 0.0 OUTLIER -49.38 152.09 2.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.67 0.748 . . . . 75.019999999999996 110.908 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.71 -8.79 24.51 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.678 2.252 . . . . 61.039999999999999 112.377 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.81 5.8 20.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 70.430000000000007 110.919 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.623 HG22 ' HB2' ' A' ' 26' ' ' GLU . 1.4 t -145.0 139.56 15.29 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.599 0.714 . . . . 72.230000000000004 111.089 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 160.68 48.78 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.702 2.268 . . . . 73.129999999999995 112.314 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' HB2' ' CE2' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -78.45 147.73 72.47 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.563 0.697 . . . . 74.430000000000007 110.921 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -69.85 170.05 17.59 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.657 2.238 . . . . 73.239999999999995 112.322 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.61 170.09 17.2 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.762 2.308 . . . . 72.430000000000007 112.363 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.85 143.99 52.12 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 71.409999999999997 112.336 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.5 m -80.98 -58.24 3.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 74.109999999999999 111.162 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.535 ' H ' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -134.05 -177.22 4.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.433 . . . . 74.439999999999998 110.921 -179.874 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.418 ' H ' HG23 ' A' ' 37' ' ' VAL . 1.7 t -59.4 -47.69 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 73.230000000000004 111.154 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.731 ' CG ' HD22 ' A' ' 15' ' ' LEU . 19.9 pt-20 -63.87 -32.26 73.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 55.140000000000001 110.802 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB3' ' H ' ' A' ' 36' ' ' SER . . . -71.51 -36.16 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.198 -0.456 . . . . 40.329999999999998 111.135 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.538 ' O ' ' HG3' ' A' ' 43' ' ' ARG . . . -68.76 -33.82 74.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 111.095 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.67 HD11 ' CB ' ' A' ' 158' ' ' PHE . 0.2 OUTLIER -62.41 -54.06 45.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 72.230000000000004 110.916 -179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.866 ' HG ' HD23 ' A' ' 94' ' ' LEU . 1.1 mm? -51.81 -46.98 64.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 65.099999999999994 110.904 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -54.07 -28.66 40.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.895 179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 0.1 OUTLIER -89.44 -44.53 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.208 -0.451 . . . . 72.010000000000005 110.848 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.751 HG11 ' CD2' ' A' ' 158' ' ' PHE . 35.0 m -91.45 -55.18 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 72.329999999999998 111.061 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.725 ' OG1' ' HB2' ' A' ' 95' ' ' ALA . 0.4 OUTLIER -50.02 -36.17 27.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 62.109999999999999 111.138 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.29 -31.51 69.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.779 -179.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.7 ' HG3' HD13 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -80.47 -33.53 36.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 55.149999999999999 110.929 -179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.7 HD13 ' HG3' ' A' ' 48' ' ' GLN . 7.6 mm -64.85 -33.35 62.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.197 -0.456 . . . . 65.319999999999993 111.185 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.701 ' O ' ' N ' ' A' ' 54' ' ' GLN . 7.1 mt-30 -80.84 -61.3 2.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 75.109999999999999 110.889 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -48.49 -19.95 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 71.219999999999999 110.867 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.584 ' HG3' ' CD2' ' A' ' 53' ' ' HIS . 10.1 pt-20 -97.26 -42.03 8.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 71.219999999999999 110.88 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.618 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 98.2 m-70 -101.93 -44.48 5.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.239999999999995 110.861 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.701 ' N ' ' O ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -36.52 -26.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 72.230000000000004 110.946 -179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 53' ' ' HIS . 3.2 mt-10 -48.72 -39.26 24.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 70.150000000000006 110.891 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -94.36 -40.15 10.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.925 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.618 ' CZ ' ' HB3' ' A' ' 53' ' ' HIS . 15.1 m-85 -53.28 -61.75 2.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 72.430000000000007 110.829 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.4 t -56.71 -42.89 79.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.491 . . . . 75.340000000000003 110.882 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.4 t -51.37 -40.72 59.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 55.340000000000003 110.899 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.591 ' C ' ' CD1' ' A' ' 60' ' ' PHE . 0.7 OUTLIER -84.32 -38.06 20.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 74.200000000000003 110.859 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 62' ' ' GLU . 0.7 OUTLIER -41.72 -41.75 2.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 45.229999999999997 110.879 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' N ' ' SG ' ' A' ' 61' ' ' CYS . 3.4 pt-20 -90.5 33.44 0.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 71.530000000000001 110.898 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.466 ' N ' ' O ' ' A' ' 60' ' ' PHE . 39.3 t -105.84 -60.32 1.65 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.878 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.443 ' HB2' ' ND2' ' A' ' 66' ' ' ASN . 8.6 mmm180 -115.02 -23.32 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 64.439999999999998 110.803 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.454 ' O ' ' NH1' ' A' ' 67' ' ' ARG . . . 89.48 13.45 61.43 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.77 -0.729 . . . . 74.120000000000005 112.483 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.518 ' O ' ' N ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -83.1 31.67 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.861 0.362 . . . . 73.329999999999998 110.924 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.756 ' O ' HD13 ' A' ' 100' ' ' LEU . 1.5 mtt85 -32.55 -34.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 64.200000000000003 110.907 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 66' ' ' ASN . 2.1 tp -75.28 -51.01 14.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 51.340000000000003 110.953 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.52 ' O ' ' NE2' ' A' ' 73' ' ' GLN . 71.6 mm-40 -51.7 -32.87 31.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.167 -0.469 . . . . 63.219999999999999 110.932 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.568 HD21 ' CE1' ' A' ' 60' ' ' PHE . 0.5 OUTLIER -76.68 -37.94 55.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 60.25 110.887 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.953 HG21 ' CG1' ' A' ' 128' ' ' ILE . 0.4 OUTLIER -59.22 -45.92 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 41.420000000000002 111.097 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.703 ' CB ' ' CE2' ' A' ' 131' ' ' PHE . 3.3 ptpt -73.02 -43.63 61.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.166 -0.47 . . . . 72.219999999999999 110.904 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 69' ' ' GLU . 2.7 mp0 -54.95 -49.02 72.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 110.885 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.672 ' HE1' ' CD1' ' A' ' 96' ' ' PHE . 19.6 mmm -57.4 -55.52 33.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.219999999999999 110.896 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.82 ' HB1' ' HG ' ' A' ' 135' ' ' LEU . . . -51.68 -21.64 2.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.172 -0.467 . . . . 62.009999999999998 111.118 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -83.51 -28.71 28.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.883 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.91 ' HG2' HD23 ' A' ' 78' ' ' LEU . 9.4 ptpt -82.35 -48.44 11.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 60.399999999999999 110.869 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.91 HD23 ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -82.25 -56.56 3.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 55.310000000000002 110.924 179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.802 HD23 HD12 ' A' ' 78' ' ' LEU . 0.1 OUTLIER -91.25 157.67 17.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 110.883 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.404 ' CB ' ' HB2' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -164.36 -175.94 4.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.222 -0.445 . . . . 65.030000000000001 110.851 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.482 ' CB ' ' HD2' ' A' ' 140' ' ' ARG . 1.4 pttt -100.54 -40.84 7.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 61.229999999999997 110.934 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -13.69 25.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 75.209999999999994 110.877 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.609 ' NE2' ' N ' ' A' ' 83' ' ' GLN . 0.1 OUTLIER -86.5 127.46 34.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 70.219999999999999 110.945 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.61 72.49 0.09 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 72.319999999999993 110.829 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.828 ' CD2' HD21 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -49.21 173.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.913 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.9 m -146.27 166.71 25.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 72.349999999999994 110.885 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 1.052 ' CE3' HD12 ' A' ' 90' ' ' LEU . 8.6 m95 -55.87 -42.05 75.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.491 . . . . 64.200000000000003 110.893 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 92' ' ' MET . 34.1 p -53.98 -35.32 61.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 73.209999999999994 110.874 -179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.533 ' HB3' ' CD2' ' A' ' 79' ' ' LEU . 6.8 mm100 -75.13 -47.2 29.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.230000000000004 110.962 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.052 HD12 ' CE3' ' A' ' 87' ' ' TRP . 9.1 mt -49.0 -54.58 15.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.25 -0.432 . . . . 53.219999999999999 110.968 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.721 HG11 ' CE1' ' A' ' 154' ' ' PHE . 35.2 m -65.57 -31.77 55.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.159 -0.473 . . . . 74.019999999999996 111.143 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.548 ' HE2' HD22 ' A' ' 78' ' ' LEU . 2.6 tmm? -60.82 -45.47 94.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 53.009999999999998 110.835 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.735 HD13 ' HB2' ' A' ' 75' ' ' ALA . 4.9 tp -61.0 -43.24 99.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 62.119999999999997 110.934 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.953 HD11 HD11 ' A' ' 16' ' ' LEU . 4.1 mp -56.65 -48.52 77.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 55.229999999999997 110.927 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.725 ' HB2' ' OG1' ' A' ' 46' ' ' THR . . . -56.13 -47.75 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.299999999999997 111.142 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.979 ' CE2' HD11 ' A' ' 100' ' ' LEU . 73.3 t80 -56.77 -60.08 4.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 71.409999999999997 110.908 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.791 ' HB2' HD21 ' A' ' 132' ' ' LEU . . . -36.37 -58.29 0.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 72.409999999999997 111.055 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.436 ' C ' ' SG ' ' A' ' 23' ' ' CYS . . . -63.33 -26.62 69.63 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 63.530000000000001 112.514 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.616 HG22 ' O ' ' A' ' 96' ' ' PHE . 0.5 OUTLIER -69.89 -27.8 65.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.786 0.327 . . . . 71.310000000000002 111.121 -179.856 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.979 HD11 ' CE2' ' A' ' 96' ' ' PHE . 2.8 mt -82.98 -52.77 6.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 54.310000000000002 110.924 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.934 ' HG3' HG23 ' A' ' 20' ' ' ILE . 62.0 mmm -33.51 108.15 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.817 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.554 ' ND2' ' C ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -87.57 161.2 17.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 73.400000000000006 110.916 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.704 ' CG ' ' HB1' ' A' ' 24' ' ' ALA . 48.8 mm-40 -144.32 131.48 20.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 62.219999999999999 110.847 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.629 ' N ' ' CD ' ' A' ' 105' ' ' PRO . . . -148.43 41.01 0.9 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.735 -0.745 . . . . 74.299999999999997 112.493 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 104' ' ' GLY . 53.7 Cg_endo -69.82 -162.87 0.1 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.671 2.247 . . . . 75.019999999999996 112.327 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.5 ' O ' ' N ' ' A' ' 108' ' ' ALA . 1.2 p90 -120.67 5.68 10.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 110.879 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.632 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.3 OUTLIER -33.78 93.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 41.119999999999997 110.925 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 106' ' ' TYR . . . -85.41 -149.58 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.263 -0.426 . . . . 63.140000000000001 111.087 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.84 HG22 ' N ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -62.28 -84.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 70.120000000000005 111.108 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.84 ' N ' HG22 ' A' ' 109' ' ' VAL . 4.5 mttt -121.28 83.99 2.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 73.310000000000002 110.884 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 108' ' ' ALA . 1.4 mp0 -79.13 160.79 26.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 72.019999999999996 110.926 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -7.13 21.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 72.420000000000002 110.851 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.9 tpp180 -123.9 147.55 47.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.27 -0.423 . . . . 55.009999999999998 110.865 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -98.66 -50.98 4.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 63.509999999999998 110.903 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.484 ' N ' HD12 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -73.0 2.66 6.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 74.109999999999999 110.926 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.445 ' C ' ' O ' ' A' ' 115' ' ' LEU . . . -34.64 107.6 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.76 -0.733 . . . . 20.219999999999999 112.527 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.502 ' ND2' ' OE1' ' A' ' 103' ' ' GLN . 1.4 m120 -158.54 126.07 5.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.783 0.325 . . . . 74.030000000000001 110.937 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.953 ' HB3' HD12 ' A' ' 120' ' ' ILE . 22.3 tpt180 -45.87 165.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 73.040000000000006 110.858 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.749 HG12 ' CG2' ' A' ' 122' ' ' THR . 0.2 OUTLIER -75.88 -11.67 14.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 74.430000000000007 111.152 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.953 HD12 ' HB3' ' A' ' 118' ' ' ARG . 0.1 OUTLIER -55.11 -29.37 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 65.439999999999998 111.06 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.917 ' H ' HD13 ' A' ' 120' ' ' ILE . 0.2 OUTLIER -71.33 -47.43 59.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 74.049999999999997 111.105 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.749 ' CG2' HG12 ' A' ' 119' ' ' VAL . 3.0 t -68.23 -43.2 78.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 74.25 111.153 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.725 ' O ' HD23 ' A' ' 127' ' ' LEU . 5.2 ptm180 -63.27 -50.61 69.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.844 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.524 ' N ' ' CG ' ' A' ' 123' ' ' ARG . 68.0 m-20 -73.37 -25.06 60.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 110.839 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.766 ' O ' HG23 ' A' ' 129' ' ' VAL . 1.6 t -67.91 -52.52 35.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.873 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 130' ' ' ASN . 2.6 t -61.4 -37.02 81.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.967 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 123' ' ' ARG . 1.9 mm? -76.0 -55.19 5.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 110.948 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.953 ' CG1' HG21 ' A' ' 71' ' ' VAL . 4.2 tt -60.66 -48.0 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 74.450000000000003 111.14 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.766 HG23 ' O ' ' A' ' 125' ' ' CYS . 33.8 t -67.66 -32.27 56.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 74.329999999999998 111.159 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.513 ' CB ' ' O ' ' A' ' 126' ' ' CYS . 2.0 t30 -59.9 -48.03 83.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 73.230000000000004 110.94 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.703 ' CE2' ' CB ' ' A' ' 72' ' ' LYS . 11.0 t80 -64.18 -54.88 26.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 71.140000000000001 110.817 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.791 HD21 ' HB2' ' A' ' 97' ' ' ALA . 0.1 OUTLIER -59.75 -55.16 37.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 55.109999999999999 110.922 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.507 ' O ' ' CB ' ' A' ' 137' ' ' MET . 43.9 t80 -45.56 -49.24 14.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 70.319999999999993 110.883 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -72.09 -27.75 62.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.932 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.82 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.56 -53.53 57.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.430000000000007 110.912 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.003 HD13 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -88.16 -19.26 27.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.183 -0.462 . . . . 74.340000000000003 110.896 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 1.003 ' N ' HD13 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -91.74 24.39 3.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 71.209999999999994 110.895 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . 0.473 ' O ' ' CB ' ' A' ' 142' ' ' ARG . . . -79.47 169.14 53.41 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.746 -0.74 . . . . 61.009999999999998 112.46 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 12.1 mmm-85 -60.27 -54.0 50.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.75 0.31 . . . . 52.140000000000001 110.785 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.482 ' HD2' ' CB ' ' A' ' 81' ' ' LYS . 0.7 OUTLIER -79.25 -38.6 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 63.329999999999998 110.871 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -65.61 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 75.219999999999999 110.828 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.728 HH12 HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.63 -41.51 81.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 53.439999999999998 110.839 -179.904 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.26 -43.2 74.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 111.141 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -76.42 -46.11 28.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 62.439999999999998 110.844 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.854 HD13 ' N ' ' A' ' 146' ' ' GLU . 0.1 OUTLIER -43.6 -45.65 6.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 65.099999999999994 110.894 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.854 ' N ' HD13 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -81.25 -30.22 34.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 65.329999999999998 110.837 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.06 -15.69 25.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 73.010000000000005 111.115 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . 0.699 ' CD1' ' CE2' ' A' ' 87' ' ' TRP . 0.4 OUTLIER -110.22 27.15 9.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 71.340000000000003 110.931 -179.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 95.06 2.17 62.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.672 -0.775 . . . . 73.319999999999993 112.491 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.493 ' CA ' ' HA ' ' A' ' 146' ' ' GLU . . . 49.22 -170.92 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.762 -0.732 . . . . 64.109999999999999 112.462 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -39.08 -38.48 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.812 0.339 . . . . 73.230000000000004 110.951 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.45 -48.68 65.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 62.310000000000002 110.871 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -64.51 -39.64 97.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.705 -0.76 . . . . 33.340000000000003 112.538 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.721 ' CE1' HG11 ' A' ' 91' ' ' VAL . 1.7 t80 -46.88 -61.85 1.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.838 0.351 . . . . 71.409999999999997 110.913 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.476 ' O ' ' N ' ' A' ' 159' ' ' LYS . 19.7 p -55.9 -32.48 63.77 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.951 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 156' ' ' ARG . 0.7 OUTLIER -73.42 -26.96 61.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 70.450000000000003 110.915 -179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 157' ' ' PHE . 3.3 t80 -77.56 -39.97 44.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 74.540000000000006 110.892 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' PHE . . . . . 0.751 ' CD2' HG11 ' A' ' 45' ' ' VAL . 91.2 m-85 -96.45 -20.0 18.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 71.420000000000002 110.905 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 155' ' ' CYS . 5.1 mmtp 64.49 84.16 0.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.864 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ASN . . . . . 0.53 ' HA ' HD22 ' A' ' 41' ' ' LEU . 2.5 t30 -48.78 142.65 8.9 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.613 0.72 . . . . 71.530000000000001 110.846 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 160' ' ' ASN . 54.3 Cg_endo -69.72 -45.45 1.61 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.738 2.292 . . . . 74.030000000000001 112.324 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.689 HD13 ' HD2' ' A' ' 163' ' ' PRO . 0.6 OUTLIER -64.74 143.36 98.72 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.567 0.699 . . . . 73.209999999999994 110.955 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.689 ' HD2' HD13 ' A' ' 162' ' ' LEU . 53.9 Cg_endo -69.7 -33.14 17.44 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.608 2.205 . . . . 65.230000000000004 112.434 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.45 HD12 ' OXT' ' A' ' 165' ' ' GLY . 0.2 OUTLIER -51.71 145.99 8.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 74.420000000000002 110.941 179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.45 ' OXT' HD12 ' A' ' 164' ' ' LEU . . . . . . . . 0 C--N 1.334 0.451 0 N-CA-C 110.269 -1.132 . . . . 64.230000000000004 110.269 179.897 . . . . . . . . 1 1 . 1 stop_ save_